SCHEMBL31661698

SCHEMBL31661698

Cn1cc(C(F)(F)F)nc1-c1ccc(-c2noc(-c3ccc(F)cc3-c3cc(Cl)cc(Cl)c3)n2)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
USP1 O94782 4/20 0.38
S1PR1 P21453 3/20 0.38
PTGS2 P35354 1/20 0.37
NPC1 O15118 4/20 0.37
RAB9A P51151 4/20 0.37
L3MBTL1 Q9Y468 3/20 0.37
CASP3 P42574 1/20 0.37
SENP8 Q96LD8 1/20 0.37
SENP7 Q9BQF6 1/20 0.37
SENP6 Q9GZR1 1/20 0.37
TP53 P04637 3/20 0.36
HPGD P15428 1/20 0.36
TSHR P16473 1/20 0.36
MAPK1 P28482 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
ALDH1A1 P00352 1/20 0.36
MAPT P10636 3/20 0.36
NR1H4 Q96RI1 1/20 0.36
LMNA P02545 1/20 0.35

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
SCHEMBL31661691 0.91 S1PR1 (0.38) USP1S1PR1PTGS2NPC1RAB9A
SCHEMBL31661537 0.90 NPC1 (0.41) USP1S1PR1NPC1RAB9AL3MBTL1
SCHEMBL31661573 0.90 PTGS1 (0.41) USP1S1PR1PTGS2NPC1RAB9A
SCHEMBL31661770 0.89 S1PR1 (0.43) S1PR1NPC1RAB9AHPGDMAPK1
SCHEMBL31661749 0.89 RAB9A (0.38) USP1S1PR1NPC1RAB9AL3MBTL1
SCHEMBL31661692 0.89 RAB9A (0.39) USP1S1PR1NPC1RAB9AL3MBTL1
SCHEMBL31661680 0.89 NPC1 (0.38) USP1S1PR1PTGS2NPC1RAB9A
SCHEMBL31661647 0.89 NPC1 (0.44) USP1S1PR1PTGS2NPC1RAB9A
SCHEMBL31661641 0.88 S1PR1 (0.46) S1PR1NPC1RAB9AL3MBTL1TP53
SCHEMBL31661606 0.88 RAB9A (0.44) USP1S1PR1NPC1RAB9AL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025151705-A1 NOVEL INHIBITORS OF DNA DAMAGE REPAIR PATHWAY VRISE THERAPEUTICS, INC. (US) 2025-07-17 WO claimed
WO-2025151705-A1 NOVEL INHIBITORS OF DNA DAMAGE REPAIR PATHWAY VRISE THERAPEUTICS, INC. (US) 2025-07-17 WO disclosed