SCHEMBL23723913

SCHEMBL23723913

N#Cc1c(Cl)c(Cl)c(Cl)c(Cl)c1Cl.N#Cc1c(F)c(Cl)c(F)c(Cl)c1F

nearest known ligand 0.62

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.62
ALDH1A1 P00352 1/20 0.62
TP53 P04637 1/20 0.62
CYP3A4 P08684 1/20 0.62
MAPT P10636 1/20 0.62
HPGD P15428 1/20 0.62
MAPK1 P28482 1/20 0.62
KMT2A Q03164 1/20 0.62
SMN1; SMN2 Q16637 1/20 0.62
TRPV4 Q9HBA0 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
SCHEMBL6443337 0.92 MEN1 (0.48) MEN1ALDH1A1TP53CYP3A4MAPT
SCHEMBL28163229 0.87 MEN1 (0.65) MEN1ALDH1A1TP53CYP3A4MAPT
SCHEMBL6446650 0.87 MEN1 (0.55) MEN1ALDH1A1TP53CYP3A4MAPT
SCHEMBL8047840 0.87 MEN1 (0.55) MEN1ALDH1A1TP53CYP3A4MAPT
SCHEMBL1793668 0.87 MEN1 (0.48) MEN1ALDH1A1TP53CYP3A4MAPT
SCHEMBL5676913 0.84 MEN1 (0.60) MEN1ALDH1A1TP53CYP3A4MAPT
SCHEMBL5677063 0.82 ALDH1A1 (0.57) MEN1ALDH1A1TP53CYP3A4MAPT
SCHEMBL6446552 0.82 MEN1 (0.43) MEN1ALDH1A1TP53CYP3A4MAPT
SCHEMBL5675095 0.82 MEN1 (0.65) MEN1ALDH1A1TP53CYP3A4MAPT
SCHEMBL5674848 0.82 MEN1 (0.50) MEN1ALDH1A1TP53CYP3A4MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2021156893-A1 PROCESS FOR PREPARATION OF 2,4,6-TRIFLUOROBENZOIC ACID SRF LIMITED (IN) 2021-08-12 WO disclosed
CN-108530301-A A kind of synthetic method of tri- fluorin benzyl amines of 2,4,6- 上海吉奉生物科技有限公司 2018-09-14 CN disclosed