SCHEMBL6859787

SCHEMBL6859787

COc1ccc(Br)cc1-c1nc(CO)c[nH]1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AMY1A P0DUB6 2/20 0.49
GRK6 P43250 1/20 0.47
MAPT P10636 3/20 0.45
RXFP1 Q9HBX9 2/20 0.45
ALDH1A1 P00352 2/20 0.45
LMNA P02545 1/20 0.45
PPARG P37231 1/20 0.45
GFER P55789 1/20 0.45
NCOA2 Q15596 1/20 0.45
NCOA1 Q15788 1/20 0.45
NPC1 O15118 2/20 0.43
TSHR P16473 1/20 0.43
RAB9A P51151 1/20 0.43
POLB P06746 2/20 0.42
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
MAPK1 P28482 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
GAA P10253 2/20 0.40
MGAM O43451 1/20 0.40

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
SCHEMBL15332234 0.76 AMY1A (0.49) AMY1AGRK6MAPTRXFP1ALDH1A1
SCHEMBL7159598 0.74 KMO (0.45) ALDH1A1GFERGAAKDM4EHSD17B10
SCHEMBL7159559 0.74 ALDH1A1 (0.47) AMY1AGRK6MAPTALDH1A1LMNA
SCHEMBL7330835 0.73 DRD2 (0.51) AMY1AGRK6MAPTRXFP1ALDH1A1
SCHEMBL7257360 0.73 DGAT1 (0.38) MAPTLMNANPC1RAB9AMEN1
SCHEMBL31429753 0.71 IDO1 (0.45) AMY1AGRK6MAPTLMNAGFER
SCHEMBL7161302 0.71 KMO (0.43) AMY1AALDH1A1GFERMEN1KMT2A
SCHEMBL5801973 0.71 HTR7 (0.44)
SCHEMBL2549690 0.70 GRK6 (0.48) AMY1AGRK6
SCHEMBL14125145 0.70 GAA (0.56) AMY1AGRK6MAPTRXFP1ALDH1A1

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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-6358955-B1 SCHIZOPHRENIA, PSYCHOLOGICAL DISORDERS, PARKINSON*S DISEASE; ANTIDEPRESSANTS NEUROGEN CORPORATION 2002-03-19 US disclosed
US-6069251-A HIGHLY SELECTIVE PARTIAL AGONISTS OR ANTAGONISTS AT BRAIN DOPAMINE RECEPTOR SUBTYPES OR PRODRUGS; DIAGNOSIS AND TREATMENT SCHIZOPHRENIA; ANTIDEPRESSANTS; CERTAIN MOVEMENT DISORDERS SUCH AS PARKINSONISM. NEUROGEN CORPORATION (US) 2000-05-30 US disclosed
US-5712392-A DOPAMINERGIC AGENTS TREATING SCHIZOPHRENIA, ANTIDEPRESSANTS FOR PARKINSON'S DISEASE NEUROGEN CORPORATION (US) 1998-01-27 US disclosed
EP-0793653-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) 1997-09-10 EP disclosed
US-5656762-A TREATING SCHIZOPHRENIA, DEPRESSION, PARKINSON*S DISEASE NEUROGEN CORPORATION (US) 1997-08-12 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
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

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

For each of this compound's patents that has machine-readable text (2 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-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 AMY1A 3311/4885GRK6 239/4885MAPT 1036/4885
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 AMY1A 3857/4885GRK6 254/4885MAPT 1515/4885

“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.