SCHEMBL31723248

SCHEMBL31723248

COc1ccc(Nc2cc(Cl)cc(N)c2C)cc1F

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BACE2 Q9Y5Z0 2/20 0.41
ABCG2 Q9UNQ0 2/20 0.41
ABCB1 P08183 1/20 0.41
ABCC1 P33527 1/20 0.41
PIK3CA P42336 1/20 0.41
TUBB1 Q9H4B7 1/20 0.40
TDO2 P48775 2/20 0.39
IDO1 P14902 1/20 0.39
LMNA P02545 3/20 0.38
MAPT P10636 2/20 0.38
THRB P10828 2/20 0.38
KMT2A Q03164 2/20 0.38
MEN1 O00255 1/20 0.38
ALDH1A1 P00352 1/20 0.38
HTT P42858 1/20 0.38
DHFR P00374 1/20 0.38
P2RY4 P51582 1/20 0.38
P2RX3 P56373 1/20 0.37
MAPK13 O15264 1/20 0.37
MAPK12 P53778 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
SCHEMBL29454056 1.00 BACE2 (0.41) BACE2ABCG2ABCB1ABCC1PIK3CA
SCHEMBL22232200 1.00 BACE2 (0.41) BACE2ABCG2ABCB1ABCC1PIK3CA
SCHEMBL22232183 0.86 ABCG2 (0.43) ABCG2ABCB1ABCC1PIK3CATUBB1
SCHEMBL31723227 0.86 ABCG2 (0.43) ABCG2ABCB1ABCC1PIK3CATUBB1
SCHEMBL29454207 0.86 ABCG2 (0.43) ABCG2ABCB1ABCC1PIK3CATUBB1
SCHEMBL29454092 0.85 ABCG2 (0.42) ABCG2ABCB1ABCC1PIK3CATUBB1
SCHEMBL22232049 0.79 MAPT (0.53) LMNAMAPTTHRBKMT2AMEN1
SCHEMBL31723254 0.79 MAPT (0.53) LMNAMAPTTHRBKMT2AMEN1
SCHEMBL22231715 0.79 ABCG2 (0.41) BACE2ABCG2ABCB1ABCC1PIK3CA
SCHEMBL29454201 0.79 ABCG2 (0.41) BACE2ABCG2ABCB1ABCC1PIK3CA

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