SCHEMBL31723249

SCHEMBL31723249

COc1cccc(Nc2cc(C)cc(N)c2Cl)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAPGEF4 Q8WZA2 1/20 0.55
NPC1 O15118 2/20 0.51
GFER P55789 2/20 0.51
GAA P10253 2/20 0.51
MEN1 O00255 5/20 0.47
KMT2A Q03164 5/20 0.47
POLB P06746 2/20 0.47
MAPT P10636 2/20 0.47
MAPK1 P28482 1/20 0.47
TSHR P16473 2/20 0.46
HTT P42858 2/20 0.46
AKR1C3 P42330 3/20 0.46
AKR1C2 P52895 3/20 0.46
EGFR P00533 2/20 0.45
ROCK1 Q13464 1/20 0.45
ERBB3 P21860 1/20 0.45
RAB9A P51151 1/20 0.44
LMNA P02545 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
IDO1 P14902 1/20 0.43

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
SCHEMBL22231952 1.00 RAPGEF4 (0.55) RAPGEF4NPC1GFERGAAMEN1
SCHEMBL29454079 1.00 RAPGEF4 (0.55) RAPGEF4NPC1GFERGAAMEN1
SCHEMBL22232357 0.84 MAPT (0.53) NPC1GAAMEN1KMT2APOLB
SCHEMBL29454142 0.84 MAPT (0.53) NPC1GAAMEN1KMT2APOLB
SCHEMBL29454112 0.84 NPSR1 (0.49) RAPGEF4NPC1POLBMAPTHTT
SCHEMBL31723203 0.82 FADS1 (0.46) RAPGEF4GFERGAAMEN1KMT2A
SCHEMBL22231908 0.82 FADS1 (0.46) RAPGEF4GFERGAAMEN1KMT2A
SCHEMBL29454046 0.82 FADS1 (0.46) RAPGEF4GFERGAAMEN1KMT2A
SCHEMBL28446903 0.81 GAA (0.65) RAPGEF4NPC1GFERGAAMEN1
SCHEMBL22231911 0.81 GAA (0.50) NPC1GFERGAAMEN1KMT2A

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