SCHEMBL31433155

SCHEMBL31433155

Fc1ccc(C(Cl)(Cl)Cl)c(F)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.42
KCNN4 O15554 1/20 0.42
CYP3A4 P08684 2/20 0.39
TDP1 Q9NUW8 2/20 0.39
TSHR P16473 1/20 0.39
MAPK1 P28482 1/20 0.39
CES2 O00748 2/20 0.38
CES1 P23141 2/20 0.38
CYP11B2 P19099 2/20 0.38
LMNA P02545 1/20 0.38
HSP90AA1 P07900 1/20 0.38
CYP19A1 P11511 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP11B1 P15538 1/20 0.38
CYP2C19 P33261 1/20 0.38
ADRA1A P35348 1/20 0.38
CYP51A1 Q16850 1/20 0.38
CA3 P07451 1/20 0.37
CA6 P23280 1/20 0.37
CA5A P35218 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
SCHEMBL11550172 1.00 ALDH1A1 (0.42) ALDH1A1KCNN4CYP3A4TDP1TSHR
SCHEMBL4463191 0.85 ALDH1A1 (0.42) ALDH1A1KCNN4CYP3A4TDP1CES2
SCHEMBL30965844 0.80 CA3 (0.42) ALDH1A1CYP3A4TDP1TSHRMAPK1
SCHEMBL11554217 0.80 CA3 (0.42) ALDH1A1CYP3A4TDP1TSHRMAPK1
SCHEMBL31297347 0.78 TSHR (0.60) ALDH1A1CYP3A4TDP1TSHRMAPK1
SCHEMBL3978795 0.78 TSHR (0.60) ALDH1A1CYP3A4TDP1TSHRMAPK1
SCHEMBL8156993 0.78 CYP3A4 (0.60) ALDH1A1CYP3A4TDP1TSHRMAPK1
SCHEMBL22932517 0.78 KCNN4 (0.41) ALDH1A1KCNN4CYP3A4MAPK1CES2
SCHEMBL29490960 0.77 KIF11 (0.52) ALDH1A1KCNN4CYP11B2CYP11B1IDO1
SCHEMBL4084187 0.77 KIF11 (0.52) ALDH1A1KCNN4CYP11B2CYP11B1IDO1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4743438-A1 AN IMPROVED PROCESS FOR THE PREPARATION OF BENZONITRILE COMPOUNDS FROM THE BENZOTRICHLORIDE COMPOUNDS Aarti Industries Limited (IN) 2026-05-20 EP disclosed
WO-2025068995-A1 AN IMPROVED PROCESS FOR THE PREPARATION OF BENZONITRILE COMPOUNDS FROM THE BENZOTRICHLORIDE COMPOUNDS AARTI INDUSTRIES LIMITED (IN) 2025-04-03 WO disclosed
CN-119661371-A Preparation method of 2-fluoro-4-methylaniline 帕潘纳(北京)科技有限公司 2025-03-21 CN disclosed
CN-119585234-A Method for producing fluorine-containing aromatic compound 大金工业株式会社 2025-03-07 CN disclosed