SCHEMBL31723217

SCHEMBL31723217

Cc1cnc(CNc2cc(F)cc(N)c2C)cn1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 17/20 0.40
CYP3A4 P08684 14/20 0.40
CYP2C19 P33261 6/20 0.40
TSHR P16473 6/20 0.40
CYP2C9 P11712 2/20 0.40
CLK4 Q9HAZ1 9/20 0.38
ALDH1A1 P00352 7/20 0.38
HSD17B10 Q99714 6/20 0.38
KDM4E B2RXH2 3/20 0.38
ALOX15 P16050 3/20 0.38
TDP1 Q9NUW8 2/20 0.38
HPGD P15428 1/20 0.38
IGF1R P08069 1/20 0.37
FGFR1 P11362 1/20 0.37
KDR P35968 1/20 0.37
MEN1 O00255 4/20 0.37
KMT2A Q03164 4/20 0.37
TP53 P04637 1/20 0.37
MAPT P10636 1/20 0.37
CASP7 P55210 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
SCHEMBL22232194 1.00 CYP1A2 (0.40) CYP1A2CYP3A4CYP2C19TSHRCYP2C9
SCHEMBL22231963 0.73 CYP1A2 (0.37) CYP1A2CYP3A4CYP2C19TSHRCYP2C9
SCHEMBL22231965 0.73 CYP1A2 (0.37) CYP1A2CYP3A4CYP2C19TSHRCYP2C9
SCHEMBL22232418 0.72 CYP1A2 (0.42) CYP1A2CYP3A4CYP2C19TSHRCYP2C9
SCHEMBL29454108 0.72 CYP1A2 (0.42) CYP1A2CYP3A4CYP2C19TSHRCYP2C9
SCHEMBL31723277 0.68 MMP13 (0.39) ALDH1A1TDP1MEN1KMT2ATP53
SCHEMBL22232147 0.68 MMP13 (0.39) ALDH1A1TDP1MEN1KMT2ATP53
SCHEMBL3984933 0.68 CYP1A2 (0.42) CYP1A2CYP3A4CYP2C19TSHRCYP2C9
SCHEMBL1920881 0.65 CYP3A4 (0.40) CYP1A2CYP3A4CYP2C19TSHRCYP2C9
SCHEMBL31723219 0.64 PLAU (0.37) CLK4ALDH1A1TDP1KDRMEN1

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-4647426-A2 3-SUBSTITUTED PHENYLAMIDINE COMPOUNDS, PREPARATION AND USE THEREOF PI Industries Ltd. (IN) 2025-11-12 EP claimed