SCHEMBL8969494

SCHEMBL8969494

Brc1ccc2c(c1)CN1C=CC=CC1=N2

nearest known ligand 0.30

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.30
ALDH1A1 P00352 1/20 0.30
POLB P06746 1/20 0.30
HPGD P15428 1/20 0.30
HSD17B10 Q99714 1/20 0.30
PNMT P11086 1/20 0.30
ASIC3 Q9UHC3 1/20 0.30

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
SCHEMBL8969120 0.88 KDM4E (0.30) KDM4EALDH1A1POLBHPGDHSD17B10
SCHEMBL8969579 0.81 EGFR (0.37) KDM4EALDH1A1POLBHPGDHSD17B10
SCHEMBL8969612 0.81 PDE3B (0.34) KDM4EALDH1A1POLBHPGDHSD17B10
SCHEMBL8968669 0.78 NPSR1 (0.31)
SCHEMBL8969712 0.74 KDM4E (0.32) KDM4EALDH1A1POLBHPGDHSD17B10
SCHEMBL8968478 0.72 ACHE (0.43) KDM4EALDH1A1POLBHPGDHSD17B10
SCHEMBL8969718 0.72 KDM4E (0.30) KDM4EALDH1A1POLBHPGDHSD17B10
SCHEMBL8968650 0.72 KDM4E (0.30) KDM4EALDH1A1POLBHPGDHSD17B10
SCHEMBL8969486 0.72 MAPK1 (0.34) KDM4EALDH1A1POLBHPGDHSD17B10
SCHEMBL8969297 0.71

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117659004-A Phenothiazine polymerization inhibitor containing pyridoquinazolinone, and preparation method and application thereof 万华化学集团股份有限公司 2024-03-08 CN claimed
CN-117659004-A Phenothiazine polymerization inhibitor containing pyridoquinazolinone, and preparation method and application thereof 万华化学集团股份有限公司 2024-03-08 CN disclosed
US-5486512-A LEARNING ENHANCEMENT WARNER-LAMBERT COMPANY (US) 1996-01-23 US disclosed
WO-1993003034-A1 QUINAZOLINE DERIVATIVES AS ACETYLCHOLINESTERASE INHIBITORS WARNER-LAMBERT COMPANY (US) 1993-02-18 WO disclosed