SCHEMBL6446650

SCHEMBL6446650

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

nearest known ligand 0.55

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.55
ALDH1A1 P00352 1/20 0.55
TP53 P04637 1/20 0.55
CYP3A4 P08684 1/20 0.55
MAPT P10636 1/20 0.55
HPGD P15428 1/20 0.55
MAPK1 P28482 1/20 0.55
KMT2A Q03164 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.55
TRPV4 Q9HBA0 1/20 0.33
KDM4E B2RXH2 1/20 0.31

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
SCHEMBL28163229 0.89 MEN1 (0.65) MEN1ALDH1A1TP53CYP3A4MAPT
SCHEMBL6443337 0.88 MEN1 (0.48) MEN1ALDH1A1TP53CYP3A4MAPT
SCHEMBL8047840 0.88 MEN1 (0.55) MEN1ALDH1A1TP53CYP3A4MAPT
SCHEMBL23723913 0.87 MEN1 (0.62) MEN1ALDH1A1TP53CYP3A4MAPT
SCHEMBL5676913 0.86 MEN1 (0.60) MEN1ALDH1A1TP53CYP3A4MAPT
SCHEMBL19021269 0.85 MEN1 (0.50) MEN1ALDH1A1TP53CYP3A4MAPT
SCHEMBL5674844 0.83 MEN1 (0.57) MEN1ALDH1A1TP53CYP3A4MAPT
SCHEMBL1793668 0.82 MEN1 (0.48) MEN1ALDH1A1TP53CYP3A4MAPT
SCHEMBL17555047 0.82 MEN1 (0.63) MEN1ALDH1A1TP53CYP3A4MAPT
SCHEMBL21879722 0.81 MEN1 (0.42) 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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1233010-B1 Method for production of organic fluorine compound NIPPON CATALYTIC CHEM IND (JP) 2005-06-15 EP disclosed
EP-0899256-B1 Method for production of organic fluorine compound NIPPON CATALYTIC CHEM IND (JP) 2003-08-06 EP disclosed
EP-1233010-A1 Method for production of organic fluorine compound Nippon Shokubai Co., Ltd. (JP) 2002-08-21 EP disclosed
US-6392084-B1 FLUORINATION OF AN ORGANO(BROMINE OR CHLORIDE) COMPOUND IN BENZONITRILE SOLVENT NIPPON SHOKUBAI CO., LTD. (JP) 2002-05-21 US disclosed
EP-0899256-A2 Method for production of organic fluorine compound NIPPON SHOKUBAI CO., LTD. (JP) 1999-03-03 EP disclosed
EP-0120575-B1 ORGANIC FLUORINE COMPOUNDS Nippon Shokubai Kagaku Kogyo Co., Ltd (JP) 1989-06-14 EP disclosed
US-4684734-A Method for manufacture or organic fluorine compounds NIPPON SHOKUBAI KK CO., LTD. (JP) 1987-08-04 US disclosed
EP-0120575-A1 Organic fluorine compounds Nippon Shokubai Kagaku Kogyo Co., Ltd (JP) 1984-10-03 EP disclosed