SCHEMBL31662970

SCHEMBL31662970

O=C1NCCN1c1ccc(Cl)c(F)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAD51 Q06609 1/20 0.44
SLC6A2 P23975 5/20 0.42
SLC6A4 P31645 5/20 0.42
SLC6A3 Q01959 5/20 0.42
ALDH1A1 P00352 2/20 0.41
POLB P06746 1/20 0.41
CYP11B2 P19099 1/20 0.40
CMA1 P23946 2/20 0.39
SUV39H2 Q9H5I1 1/20 0.39
RORC P51449 1/20 0.38
MMP2 P08253 1/20 0.38
ADAMTS5 Q9UNA0 1/20 0.38
ITGB3 P05106 1/20 0.37
ITGB1 P05556 1/20 0.37
ITGAV P06756 1/20 0.37
ITGA5 P08648 1/20 0.37
ITGA4 P13612 1/20 0.37
ITGB5 P18084 1/20 0.37
ITGB8 P26012 1/20 0.37
IDO1 P14902 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
SCHEMBL15596119 0.87 DRD2 (0.48) RAD51SLC6A2SLC6A4SLC6A3ALDH1A1
SCHEMBL28199408 0.85 SLC6A2 (0.56) SLC6A2SLC6A4SLC6A3CMA1BCL2A1
SCHEMBL24196350 0.82 ALDH1A1 (0.42) ALDH1A1POLBCMA1TDO2ALOX5
SCHEMBL16965435 0.81 TDO2 (0.39) ALDH1A1POLBCMA1TDO2ALOX5
SCHEMBL18640602 0.81 ALDH1A1 (0.38) ALDH1A1POLBCMA1TDO2ALOX5
SCHEMBL8257893 0.81 ALDH1A1 (0.42) ALDH1A1POLBCMA1TDO2ALOX5
SCHEMBL13664744 0.79 SLC6A2 (0.48) RAD51SLC6A2SLC6A4SLC6A3CYP11B2
SCHEMBL38658736 0.77 THRB (0.40) ALDH1A1POLBTDO2ALOX5
SCHEMBL305860 0.77 ALDH1A1 (0.55) ALDH1A1POLBALOX5
SCHEMBL8250866 0.76 F10 (0.47) SLC6A2SLC6A4SLC6A3ALDH1A1IDO1

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-2025149498-A1 BENZYLPIPERIDINE DERIVATIVES AS TRP4 ANTAGONISTS FOR THE TREATMENT OF INFLAMMATORY DISEASES ASTRAZENECA AB (SE) 2025-07-17 WO disclosed