SCHEMBL9051290

SCHEMBL9051290

CCCCn1nc(CNC)c(N)c1N

nearest known ligand 0.34

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 2/20 0.34
SLC6A4 P31645 2/20 0.34
HTR2A P28223 1/20 0.34
NR1H3 Q13133 1/20 0.33
CNR1 P21554 1/20 0.31
CNR2 P34972 1/20 0.31
USP2 O75604 1/20 0.30

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
SCHEMBL1800881 0.74 GAA (0.42)
SCHEMBL693077 0.71 GRK6 (0.36) NR1H3CNR1CNR2
SCHEMBL692560 0.69 MPO (0.40) NR1H3
SCHEMBL5767901 0.68 TLR8 (0.37) CNR1CNR2
SCHEMBL1800092 0.67 HPGD (0.37)
SCHEMBL19642681 0.67 ALDH1A1 (0.37) CNR1CNR2
SCHEMBL1074576 0.67 CNR1 (0.38) CNR1CNR2
SCHEMBL1804129 0.67
SCHEMBL1075720 0.67 ALDH1A1 (0.37) CNR1CNR2
SCHEMBL693498 0.67 ALDH1A1 (0.37) CNR1CNR2

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-1996034591-A1 DIAMINOPYRAZOLE-CONTAINING COMPOSITIONS FOR COLOURING KERATIN FIBRES, COLOURING PROCESS, NOVEL DIAMINOPYRAZOLES AND METHOD FOR THEIR PREPARATION L'OREAL (FR) 1996-11-07 WO claimed