SCHEMBL31661787

SCHEMBL31661787

CC(C)c1ccccc1-c1ccc(N2CCN(C)CC2)c(-c2nc(-c3ccc(-c4nc(C(F)(F)F)cn4C)cc3)no2)c1

nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
USP1 O94782 10/20 0.44
ALDH1A1 P00352 1/20 0.40
S1PR1 P21453 2/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2D6 P10635 1/20 0.38
CYP2C19 P33261 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
MAPT P10636 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
SCHEMBL31661552 0.86 USP1 (0.48) USP1S1PR1SMN1; SMN2MAPT
SCHEMBL31661726 0.84 USP1 (0.41) USP1ALDH1A1S1PR1SMN1; SMN2
SCHEMBL31661677 0.83 USP1 (0.52) USP1S1PR1SMN1; SMN2
SCHEMBL31661653 0.83 USP1 (0.52) USP1S1PR1SMN1; SMN2
SCHEMBL31661610 0.80 USP1 (0.47) USP1S1PR1SMN1; SMN2
SCHEMBL31661803 0.79 USP1 (0.58) USP1
SCHEMBL31661724 0.78 USP1 (0.41) USP1S1PR1CYP1A2CYP2D6CYP2C19
SCHEMBL31661564 0.77 MEN1 (0.44) USP1ALDH1A1S1PR1SMN1; SMN2MAPT
SCHEMBL31661670 0.77 USP1 (0.54) USP1
SCHEMBL31661695 0.77 S1PR1 (0.46) USP1S1PR1SMN1; SMN2MAPT

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 1 patent. 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 disclosed