SCHEMBL5377464

SCHEMBL5377464

O=CCC(C(=O)c1ccccc1)c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.52
TDP1 Q9NUW8 1/20 0.52
LMNA P02545 4/20 0.51
HSD17B10 Q99714 1/20 0.51
ALDH1A1 P00352 4/20 0.51
SMN1; SMN2 Q16637 3/20 0.51
MITF O75030 1/20 0.51
HTT P42858 1/20 0.51
RAB9A P51151 1/20 0.51
GFER P55789 1/20 0.51
PAX8 Q06710 1/20 0.51
ATM Q13315 1/20 0.51
CES2 O00748 1/20 0.50
CES1 P23141 1/20 0.50
CYP2C19 P33261 1/20 0.49
CYP1A1 P04798 1/20 0.48
CYP19A1 P11511 1/20 0.48
PTPN1 P18031 5/20 0.44
MDM2 Q00987 1/20 0.43
NTSR1 P30989 2/20 0.43

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
SCHEMBL10785407 0.90 LMNA (0.58) L3MBTL1TDP1LMNAHSD17B10ALDH1A1
SCHEMBL11867756 0.84 LMNA (0.44) L3MBTL1TDP1LMNAHSD17B10ALDH1A1
SCHEMBL8737261 0.84 CYP2C19 (0.71) L3MBTL1TDP1LMNAHSD17B10ALDH1A1
SCHEMBL23457202 0.84 LMNA (0.54) L3MBTL1TDP1LMNAHSD17B10ALDH1A1
SCHEMBL3308217 0.82 CYP2C19 (0.69) LMNAHSD17B10ALDH1A1SMN1; SMN2CYP2C19
SCHEMBL9902119 0.82 ALDH1A1 (0.49) L3MBTL1TDP1LMNAHSD17B10ALDH1A1
SCHEMBL6127341 0.82 ALDH1A1 (0.49) L3MBTL1TDP1LMNAHSD17B10ALDH1A1
SCHEMBL7580361 0.80 L3MBTL1 (0.59) L3MBTL1TDP1LMNAHSD17B10ALDH1A1
SCHEMBL10556985 0.80 CYP2C19 (0.47) L3MBTL1TDP1LMNAHSD17B10ALDH1A1
SCHEMBL15658358 0.80 ALDH1A1 (0.47) L3MBTL1TDP1LMNAHSD17B10ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103459467-B Polybenzoxazole resin and precursor thereof MITSUBISHI GAS CHEMICAL CO.,INC. (JP) 2016-04-06 CN claimed
CN-103459467-B Polybenzoxazole resin and precursor thereof MITSUBISHI GAS CHEMICAL CO.,INC. (JP) 2016-04-06 CN disclosed
CN-103459467-A Polybenzoxazole resin and precursor thereof MITSUBISHI GAS CHEMICAL CO 2013-12-18 CN disclosed
CN-100355714-C Arylpiperazines having 5-hydroxyl-typtamine activity LILLY CO ELI (US) 2007-12-19 CN disclosed
US-7309702-B2 4-(3-Phenyl-3-carbocycloylpropyl)-1-phenyl- or pyridylpiperazine derivatives: 1-(2-methoxyphenyl)-4-[3-(benzoyl)-3-(phenyl)propyl]piperazine oxalate; serotonin receptor antagonists; Alzheimer's disease AVERA PHARMACEUTICALS, INC. (US) 2007-12-18 US disclosed
CN-1743302-A Arylpiperazines having 5-hydroxyl-typtamine activity LILLY CO ELI (US) 2006-03-08 CN disclosed
US-7001908-B2 Arylpiperazines having activity at the serotonin 1A receptor AVERA PHARMACEUTICALS, INC. (US) 2006-02-21 US disclosed
US-20060009464-A1 Arylpiperazines having activity at the serotonin 1A receptor ELI LILLY AND COMPANY 2006-01-12 US disclosed
US-20050282817-A1 4-(3-Phenyl-3-carbocycloylpropyl)-1-phenyl- or pyridylpiperazine derivatives: 1-(2-methoxyphenyl)-4-[3-(benzoyl)-3-(phenyl)propyl]piperazine oxalate; serotonin receptor antagonists; obesity NOKIA CORPORATION (FI) 2005-12-22 US disclosed
CN-1227241-C Having 5-hydroxytryptamine 1AReceptor-active arylpiperazines LILLY CO ELI (US) 2005-11-16 CN disclosed
EP-1100501-A1 PYRROLIDINE AND PYRROLINE DERIVATIVES HAVING EFFECTS ON SEROTONIN RELATED SYSTEMS ELI LILLY AND COMPANY (US) 2001-05-23 EP disclosed
EP-1091741-A1 AZEPINE DERIVATIVES HAVING EFFECTS ON SEROTONIN RELATED SYSTEMS ELI LILLY AND COMPANY (US) 2001-04-18 EP disclosed
CN-1290258-A Aryl piperazine compounds with 5-hydroxytryptamine 1A receptor activity LILLY CO ELI (US) 2001-04-04 CN disclosed
EP-0982304-A1 Piperidine derivatives having effects on serotonin related systems ELI LILLY AND COMPANY (US) 2000-03-01 EP disclosed
WO-2000000203-A1 AZEPINE DERIVATIVES HAVING EFFECTS ON SEROTONIN RELATED SYSTEMS ELI LILLY AND COMPANY (US) 2000-01-06 WO disclosed
WO-2000000196-A1 PYRROLIDINE AND PYRROLINE DERIVATIVES HAVING EFFECTS ON SEROTONIN RELATED SYSTEMS ELI LILLY AND COMPANY (US) 2000-01-06 WO disclosed
WO-2000000198-A1 PIPERIDINE DERIVATIVES HAVING EFFECTS ON SEROTONIN RELATED SYSTEMS ELI LILLY AND COMPANY (US) 2000-01-06 WO disclosed
WO-1999031077-A1 ARYLPIPERAZINES HAVING ACTIVITY AT THE SEROTONIN 1A RECEPTOR ELI LILLY AND COMPANY (US) 1999-06-24 WO disclosed
EP-0924205-A1 Arylpiperazines having activity at the serotonin 1a receptor ELI LILLY AND COMPANY (US) 1999-06-23 EP disclosed
CN-1097417-A New heterogeneous ring compound FUJISAWA PHARMACEUTICAL CO (JP) 1995-01-18 CN 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-20060009464-A1 Arylpiperazines having activity at the serotonin 1A receptor HTR1A, HTR2A, HTR3A L3MBTL1 3909/4885TDP1 1281/4885LMNA 4610/4885
US-20050282817-A1 4-(3-Phenyl-3-carbocycloylpropyl)-1-phenyl- or pyridylpiperazine derivatives: 1-(2-methoxyphenyl)-4-[3-(benzoyl)-3-(phenyl)propyl]piperazine oxalate; serotonin receptor antagonists; obesity HTR3A, HTR3C, HTR1A L3MBTL1 3435/4885TDP1 1901/4885LMNA 4315/4885

“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.