SCHEMBL24094240

SCHEMBL24094240

CCCc1ccc(-c2nnc(Nc3ccc(N)c(C=N)c3)[nH]2)cc1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPBWR1 P48145 1/20 0.35
▸ RAB9A P51151 4/20 0.35
▸ NPC1 O15118 3/20 0.35
▸ MAPT P10636 2/20 0.35
▸ GFER P55789 1/20 0.35
▸ TP53 P04637 3/20 0.34
▸ SMN1; SMN2 Q16637 3/20 0.34
▸ HSD17B10 Q99714 2/20 0.34
▸ HPGD P15428 1/20 0.34
▸ XBP1 P17861 1/20 0.34
▸ HTT P42858 1/20 0.34
▸ ATM Q13315 1/20 0.34
▸ TSHR P16473 1/20 0.32
▸ KIT P10721 1/20 0.32
▸ MET P08581 1/20 0.32
▸ KDR P35968 1/20 0.32
▸ MCHR1 Q99705 1/20 0.32
▸ NISCH Q9Y2I1 1/20 0.31
▸ PKM P14618 1/20 0.30
▸ KDM4E B2RXH2 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
SCHEMBL24094162 0.84 CTDSP1 (0.39) RAB9ANPC1MAPTTP53SMN1; SMN2
SCHEMBL24094128 0.79 PLG (0.34) RAB9ANPC1TP53HSD17B10
SCHEMBL24610274 0.79 HTR1D (0.32) RAB9ANPC1TP53HSD17B10
SCHEMBL24094118 0.79 PRMT5 (0.41) RAB9AMAPTSMN1; SMN2
SCHEMBL24094175 0.76 KMT2A (0.39) RAB9ANPC1MAPTTP53HPGD
SCHEMBL24094286 0.73 IKBKE (0.36) MAPTTP53SMN1; SMN2HSD17B10HPGD
SCHEMBL24610300 0.73 JAK2 (0.34) SMN1; SMN2
SCHEMBL24610275 0.73 ALDH1A1 (0.38) TP53HSD17B10KDM4E
SCHEMBL24610309 0.73 IKBKE (0.39) ATM
SCHEMBL22967237 0.73 CYP1A2 (0.43) MAPTSMN1; SMN2HSD17B10HPGDKDM4E

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
EP-3743420-B1 HETEROCYCLYLAMINO-SUBSTITUTED TRIAZOLES AS MODULATORS OF RHO-ASSOCIATED PROTEIN KINASE REDX PHARMA PLC (GB) 2021-12-15 — — EP disclosed
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