SCHEMBL30102069

SCHEMBL30102069

CC(CO)n1cnc2c(-c3cccnc3)nc(-c3ccc(C(F)(F)F)nc3)cc2c1=O

nearest known ligand 0.38

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TRPV3 Q8NET8 7/20 0.38
PTGS1 P23219 1/20 0.38
PTGS2 P35354 1/20 0.38
HSP90AA1 P07900 2/20 0.37
KDM5B Q9UGL1 1/20 0.37
TRPA1 O75762 3/20 0.36
SYK P43405 2/20 0.36
AHR P35869 1/20 0.36

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
SCHEMBL23390164 1.00 TRPV3 (0.38) TRPV3PTGS1PTGS2HSP90AA1KDM5B
SCHEMBL23390167 1.00 TRPV3 (0.38) TRPV3PTGS1PTGS2HSP90AA1KDM5B
SCHEMBL23390273 0.93 KDM5B (0.41) TRPV3KDM5BSYK
SCHEMBL23390274 0.93 KDM5B (0.41) TRPV3KDM5BSYK
SCHEMBL23950679 0.92 TRPV3 (0.41) TRPV3PTGS1PTGS2HSP90AA1KDM5B
SCHEMBL23390403 0.91 TRPA1 (0.35) TRPV3KDM5BTRPA1AHR
SCHEMBL23390259 0.91 EGLN1 (0.40) TRPV3PTGS1PTGS2AHR
SCHEMBL30101937 0.91 EGLN1 (0.40) TRPV3PTGS1PTGS2AHR
SCHEMBL23390257 0.91 EGLN1 (0.40) TRPV3PTGS1PTGS2AHR
SCHEMBL23390485 0.91 TRPV3 (0.38) TRPV3KDM5BTRPA1SYK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115443276-B Pyridopyrimidinone derivatives and their use as arene receptor modulators 东亚ST株式会社 2025-04-18 CN claimed
CN-115443276-B Pyridopyrimidinone derivatives and their use as arene receptor modulators 东亚ST株式会社 2025-04-18 CN disclosed
CN-115443276-A Pyridopyrimidinone derivatives and their use as modulators of aromatic hydrocarbon receptors 东亚ST株式会社 2022-12-06 CN disclosed