SCHEMBL4884328

SCHEMBL4884328

CCOC(=O)c1nc(-c2ccccc2)c[nH]1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 6/20 0.51
KDM4E B2RXH2 5/20 0.51
RAB9A P51151 5/20 0.51
NPC1 O15118 4/20 0.51
ALDH1A1 P00352 4/20 0.51
MAPT P10636 3/20 0.51
HPGD P15428 3/20 0.51
LMNA P02545 2/20 0.51
GAA P10253 1/20 0.51
NPSR1 Q6W5P4 1/20 0.51
MAPK1 P28482 2/20 0.49
TDP1 Q9NUW8 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
ADORA3 P0DMS8 2/20 0.48
JAK2 O60674 1/20 0.47
JAK3 P52333 1/20 0.47
CCR6 P51684 1/20 0.47
CDC7 O00311 1/20 0.47
TRPM8 Q7Z2W7 1/20 0.47
DBF4 Q9UBU7 1/20 0.47

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL7489817 0.87 JAK2 (0.52) SMN1; SMN2KDM4ERAB9ANPC1ALDH1A1
SCHEMBL858475 0.86 HTT (0.53) SMN1; SMN2KDM4ERAB9ANPC1MAPT
SCHEMBL13932377 0.86 ALPL (0.41) KDM4ERAB9ANPC1ALDH1A1MAPT
SCHEMBL14531550 0.83 KDM4E (0.40) KDM4ERAB9ANPC1ALDH1A1MAPT
SCHEMBL259469 0.83 GAA (0.51) SMN1; SMN2KDM4EALDH1A1HPGDGAA
SCHEMBL8822098 0.80 PDGFRB (0.38) SMN1; SMN2KDM4ERAB9AALDH1A1MAPT
SCHEMBL14072015 0.79 SMN1; SMN2 (0.56) SMN1; SMN2KDM4ERAB9ANPC1ALDH1A1
SCHEMBL20199406 0.79 KMT2A (0.38) SMN1; SMN2KDM4ERAB9ANPC1ALDH1A1
SCHEMBL20477417 0.78 SMN1; SMN2 (0.56) SMN1; SMN2KDM4ERAB9ANPC1ALDH1A1
SCHEMBL9324010 0.77 TP53 (0.44) SMN1; SMN2KDM4ERAB9ANPC1ALDH1A1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 25 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108834415-B Substituted tricyclic 1, 4-benzodiazepine derivatives as allosteric modulators of group II metabotropic glutamate receptors 多曼治疗学公司 2021-12-24 CN disclosed
US-11008323-B2 Substituted tricyclic 1,4-benzodiazepinone derivatives as allosteric modulators of group II metabotropic glutamate receptors DOMAIN THERAPEUTICS (FR) 2021-05-18 US disclosed
US-20180346468-A1 SUBSTITUTED TRICYCLIC 1,4-BENZODIAZEPINONE DERIVATIVES AS ALLOSTERIC MODULATORS OF GROUP II METABOTROPIC GLUTAMATE RECEPTORS DOMAIN THERAPEUTICS (FR) 2018-12-06 US disclosed
CN-108834415-A Substituted tricyclic 1, 4-benzodiazepine ketone derivatives as allosteric modulators of group II metabotropic glutamate receptors 马瓦隆治疗有限公司 2018-11-16 CN disclosed
EP-3374360-A1 SUBSTITUTED TRICYCLIC 1,4-BENZODIAZEPINONE DERIVATIVES AS ALLOSTERIC MODULATORS OF GROUP II METABOTROPIC GLUTAMATE RECEPTORS Mavalon Therapeutics Limited (GB) 2018-09-19 EP disclosed
WO-2017081483-A1 SUBSTITUTED TRICYCLIC 1,4-BENZODIAZEPINONE DERIVATIVES AS ALLOSTERIC MODULATORS OF GROUP II METABOTROPIC GLUTAMATE RECEPTORS MAVALON THERAPEUTICS LIMITED (GB) 2017-05-18 WO disclosed
US-20080255202-A1 Phenylthioacetic Acid Derivatives and Use Thereof BAYER HEALTHCARE AG (DE) 2008-10-16 US disclosed
US-6797824-B2 UEFUL IN THE DIAGNOSIS AND THERAPY OF AFFECTIVE DISORDERS SUCH AS SCHIZOPHRENIA AND DEPRESSION AS WELL AS CERTAIN MOVEMENT DISORDERS SUCH AS PARKINSONISM NEUROGEN CORPORATION 2004-09-28 US disclosed
US-20030018025-A1 Certain 4-aminomethyl-2-substituted imidazole derivatives and 2-aminomethyl-4-substituted imidazole derivatives: new classes of dopamine receptor subtype specific ligands NEUROGEN CORPORATION, CORPORATION OF THE STATE OF DELAWARE 2003-01-23 US disclosed
US-20020143044-A1 Certain 4-aminomethyl-2-substituted imidazole derivatives and 2-aminomethyl-4-substituted imidazole derivatives; new classes of dopamine receptor subtype specific ligands NEUROGEN CORPORATION 2002-10-03 US disclosed
US-5646281-A FOR USE IN THE DIAGNOSIS AND TREATMENT OF SCHIZOPHRENIA, DEPRESSION AND PARKINSON*S DISEASE NEUROGEN CORPORATION (US) 1997-07-08 US disclosed
US-5633377-A DIAGNOSIS, THERAPY OF SCHIZOPHRENIA, DEPRESSION, PARKINSON'SDISEASE NEUROGEN CORPORATION (US) 1997-05-27 US disclosed
EP-0506194-B1 4-aryl-thiazole or imidazole derivatives AKZO NOBEL NV (NL) 1996-08-21 EP disclosed
WO-1996016040-A1 CERTAIN 4-AMINOMETHYL-2-SUBSTITUTED IMIDAZOLE DERIVATIVES AND 2-AMINOMETHYL-4-SUBSTITUTED IMIDAZOLE DERIVATIVES; NEW CLASSES OF DOPAMINE RECEPTOR SUBTYPE SPECIFIC LIGANDS NEUROGEN CORPORATION (US) 1996-05-30 WO disclosed
US-5462959-A 4-aryl-imidazole derivatives AKZO N.V. (NL) 1995-10-31 US disclosed
EP-0365030-B1 Imidazole compound and process for preparing the same ISHIHARA SANGYO KAISHA (JP) 1994-01-26 EP disclosed
US-5254575-A 4-aryl-thiazole derivatives AKZO N.V. (NL) 1993-10-19 US disclosed
EP-0506194-A1 4-aryl-thiazole or imidazole derivatives Akzo Nobel N.V. (NL) 1992-09-30 EP disclosed
US-5023336-A Fungicides, biocides ISHIHARA SANGYO KAISHA LTD. (JP) 1991-06-11 US disclosed
EP-0365030-A1 Imidazole compound and process for preparing the same ISHIHARA SANGYO KAISHA, Ltd. (JP) 1990-04-25 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (5 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20180346468-A1 SUBSTITUTED TRICYCLIC 1,4-BENZODIAZEPINONE DERIVATIVES AS ALLOSTERIC MODULATORS OF GROUP II METABOTROPIC GLUTAMATE RECEPTORS GRM3, GRM1, GRM2 SMN1; SMN2 3142/4885KDM4E 1300/4885RAB9A 2054/4885
US-20030018025-A1 Certain 4-aminomethyl-2-substituted imidazole derivatives and 2-aminomethyl-4-substituted imidazole derivatives: new classes of dopamine receptor subtype specific ligands CHRNA4, GRIA4, OPRM1 SMN1; SMN2 3134/4885KDM4E 1670/4885RAB9A 1331/4885
US-20020143044-A1 Certain 4-aminomethyl-2-substituted imidazole derivatives and 2-aminomethyl-4-substituted imidazole derivatives; new classes of dopamine receptor subtype specific ligands DRD2, OPRM1, OPRD1 SMN1; SMN2 3260/4885KDM4E 1563/4885RAB9A 613/4885
US-11008323-B2 Substituted tricyclic 1,4-benzodiazepinone derivatives as allosteric modulators of group II metabotropic glutamate receptors GRM3, GRM1, GRM2 SMN1; SMN2 3142/4885KDM4E 1300/4885RAB9A 2054/4885
US-20080255202-A1 Phenylthioacetic Acid Derivatives and Use Thereof PAH, TST, MPST SMN1; SMN2 4675/4885KDM4E 3732/4885RAB9A 3782/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.