SCHEMBL1377576

SCHEMBL1377576

[c]1nc2c(-c3cc4ccccc4o3)cccc2s1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 4/20 0.48
MAOA P21397 3/20 0.48
RAB9A P51151 5/20 0.42
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
NPC1 O15118 5/20 0.41
MAPT P10636 3/20 0.41
PTPRC P08575 1/20 0.39
PTPN1 P18031 1/20 0.39
POLB P06746 1/20 0.39
PDE4D Q08499 1/20 0.38
HTR2C P28335 1/20 0.38
ADRA2A P08913 2/20 0.38
GALK1 P51570 1/20 0.38
METAP2 P50579 1/20 0.38
CYP19A1 P11511 1/20 0.37
GRM4 Q14833 1/20 0.37
KDM4E B2RXH2 1/20 0.37
ALDH1A1 P00352 1/20 0.37
CYP1A2 P05177 1/20 0.37

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
SCHEMBL38628 0.75 MAOB (0.51) MAOBMAOARAB9AMEN1KMT2A
SCHEMBL787149 0.75 TOP2A (0.53) RAB9AMEN1KMT2ANPC1MAPT
SCHEMBL10411212 0.75
SCHEMBL7754182 0.73 KDM4E (0.37) RAB9AMEN1KMT2AMAPTKDM4E
SCHEMBL1136612 0.72 MAOB (0.48) MAOBMAOARAB9AMEN1KMT2A
SCHEMBL4337978 0.72 LIMK1 (0.39) METAP2ALDH1A1HPGDHSD17B10
SCHEMBL915916 0.72 HSD17B10 (0.36) MAOBRAB9AMEN1KMT2ANPC1
SCHEMBL12854020 0.71 MAOB (0.71) MAOBMAOARAB9AMEN1KMT2A
SCHEMBL61411 0.71 MAOB (0.71) MAOBMAOARAB9AMEN1KMT2A
SCHEMBL290970 0.70 ESR1 (0.43) MAOBMAPTKDM4EALDH1A1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-4746878-B2 2011-08-10 JP claimed
EP-1581518-B1 SUBSTITUTED 1-PIPERIDIN-4-YL-4-PYRROLIDIN-3-YL-PIPERAZINE DERIVATIVES AND THEIR USE AS NEUROKININ ANTAGONISTS JANSSEN PHARMACEUTICA NV (BE) 2011-03-02 EP claimed
JP-2006514027-A 2006-04-27 JP claimed
EP-1581518-A2 SUBSTITUTED 1-PIPERIDIN-4-YL-4-PYRROLIDIN-3-YL-PIPERAZINE DERIVATIVES AND THEIR USE AS NEUROKININ ANTAGONISTS JANSSEN PHARMACEUTICA N.V. (BE) 2005-10-05 EP claimed
WO-2004056799-A2 SUBSTITUTED 1-PIPERIDIN-4-YL-4-PYRROLIDIN-3-YL-PIPERAZINE DERIVATIVES AND THEIR USE AS NEUROKININ ANTAGONISTS JANSSEN PHARMACEUTICA N.V. (BE) 2004-07-08 WO claimed
US-10710992-B2 Substituted pyridinones as bromodomain inhibitors ZENITH EPIGENETICS LTD. (CA) 2020-07-14 US disclosed
US-20170320866-A1 SUBSTITUTED PYRIDINONES AS BROMODOMAIN INHIBITORS ZENITH EPIGENETICS CORP. (CA) 2017-11-09 US disclosed
EP-1581518-B1 SUBSTITUTED 1-PIPERIDIN-4-YL-4-PYRROLIDIN-3-YL-PIPERAZINE DERIVATIVES AND THEIR USE AS NEUROKININ ANTAGONISTS JANSSEN PHARMACEUTICA NV (BE) 2011-03-02 EP disclosed
EP-1651232-A4 COMPOUNDS FOR INFLAMMATION AND IMMUNE-RELATED USES SYNTA PHARMACEUTICALS CORP (US) 2007-06-06 EP disclosed
EP-1651232-A2 COMPOUNDS FOR INFLAMMATION AND IMMUNE-RELATED USES Synta Pharmaceuticals Corporation (US) 2006-05-03 EP disclosed
WO-2005009539-A2 COMPOUNDS FOR INFLAMMATION AND IMMUNE-RELATED USES SYNTA PHARMACEUTICALS, CORP. (US) 2005-02-03 WO disclosed
EP-0114306-B1 HIGH SENSITIVITY AND DEVELOPABILITY MULTILAYER COLOR PHOTOGRAPHIC MATERIAL MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1989-01-18 EP disclosed
EP-0114306-A2 High sensitivity and developability multilayer color photographic material MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1984-08-01 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 (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-20170320866-A1 SUBSTITUTED PYRIDINONES AS BROMODOMAIN INHIBITORS BRD4, BRD3, BRD1 MAOB 1907/4885MAOA 3377/4885RAB9A 3287/4885
US-10710992-B2 Substituted pyridinones as bromodomain inhibitors BRD4, BRD3, BRD1 MAOB 1907/4885MAOA 3377/4885RAB9A 3287/4885

“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.