SCHEMBL31363362

SCHEMBL31363362

CC(C)Cn1ccc2c(N)cc(I)cc21

nearest known ligand 0.44

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SLC2A1 P11166 1/20 0.44
TLR7 Q9NYK1 1/20 0.40
HTR2C P28335 16/20 0.38
HTR2A P28223 13/20 0.38

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
SCHEMBL15652025 0.76 HTR2C (0.55) SLC2A1TLR7HTR2CHTR2A
SCHEMBL31363983 0.76 MAPT (0.33)
SCHEMBL31363601 0.75 ASH1L (0.39)
SCHEMBL31363716 0.74 GRIN2B (0.38)
SCHEMBL18280717 0.69 HTR2C (0.47) SLC2A1TLR7HTR2CHTR2A
SCHEMBL26673694 0.67 HTR2C (0.45) SLC2A1TLR7HTR2CHTR2A
SCHEMBL15712674 0.66 HTR2C (0.55) SLC2A1HTR2CHTR2A
SCHEMBL32682390 0.66 SLC2A1 (0.44) SLC2A1TLR7HTR2CHTR2A
SCHEMBL470116 0.65 ACACB (0.42) SLC2A1TLR7HTR2CHTR2A
SCHEMBL2608958 0.62 HTR2A (0.48) SLC2A1HTR2CHTR2A

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-2025059074-A1 BICYCLIC COMPOUNDS FOR RESTORING MUTANT P53 FUNCTION PMV PHARMACEUTICALS, INC. (US) 2025-03-20 WO disclosed