SCHEMBL7595992

SCHEMBL7595992

Cn1nc(-c2cc(C=C(Cl)C(=O)O)c(Cl)cc2F)c(Cl)c1C(F)(F)F

nearest known ligand 0.32

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.32
MAPK1 P28482 1/20 0.32
MEN1 O00255 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31
KMT2A Q03164 1/20 0.31
NOTUM Q6P988 1/20 0.30
RORC P51449 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
SCHEMBL7960682 1.00 MAPT (0.32) MAPTMAPK1MEN1CYP1A2CYP2C9
SCHEMBL7591610 0.92 MEN1 (0.32) MAPTMAPK1MEN1CYP1A2CYP2C9
SCHEMBL7960676 0.92 MEN1 (0.32) MAPTMAPK1MEN1CYP1A2CYP2C9
SCHEMBL7982212 0.90 RXRA (0.32) MAPTMAPK1MEN1CYP1A2CYP2C9
SCHEMBL7982209 0.90 RXRA (0.32) MAPTMAPK1MEN1CYP1A2CYP2C9
SCHEMBL7592581 0.86
SCHEMBL7591494 0.86 HTR2A (0.30)
SCHEMBL7973890 0.86 HTR2A (0.30)
SCHEMBL7159842 0.85 NOTUM (0.31) MEN1CYP1A2CYP2C9CYP2C19KMT2A
SCHEMBL7886193 0.85 NOTUM (0.31) MEN1CYP1A2CYP2C9CYP2C19KMT2A

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-0915853-B1 SUBSTITUTED 3-PHENYL PYRAZOLES BASF AG (DE) 2002-11-06 EP disclosed
US-6197973-B1 HERBICIDES BASF AKTIENGESELLSCHAFT (DE) 2001-03-06 US disclosed
EP-0915853-A1 SUBSTITUTED 3-PHENYL PYRAZOLES BASF AKTIENGESELLSCHAFT (DE) 1999-05-19 EP disclosed
WO-1998005649-A1 SUBSTITUTED 3-PHENYL PYRAZOLES BASF AKTIENGESELLSCHAFT (DE) 1998-02-12 WO disclosed