SCHEMBL7940897

SCHEMBL7940897

O=C(c1ccc(O)cc1)c1ccc(OC(Cl)(Cl)Cl)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.58
MAPT P10636 3/20 0.58
HPGD P15428 3/20 0.58
HTT P42858 2/20 0.58
ESR1 P03372 1/20 0.58
ESR2 Q92731 1/20 0.58
PKM P14618 1/20 0.58
ELANE P08246 4/20 0.56
MAPK1 P28482 2/20 0.53
SRD5A2 P31213 1/20 0.50
PPARG P37231 2/20 0.47
PPARA Q07869 2/20 0.47
FABP2 P12104 1/20 0.47
SLC22A12 Q96S37 1/20 0.47
MEN1 O00255 4/20 0.46
KMT2A Q03164 4/20 0.46
RAB9A P51151 2/20 0.46
PARP10 Q53GL7 1/20 0.44
SMN1; SMN2 Q16637 2/20 0.43
TDP1 Q9NUW8 2/20 0.42

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
SCHEMBL7938157 0.85 ESR2 (0.50) LMNAMAPTHPGDESR1ESR2
SCHEMBL7937365 0.83 LTA4H (0.48) LMNAMAPTHPGDELANEMAPK1
SCHEMBL5541822 0.81 ESR1 (0.58) LMNAMAPTHPGDHTTESR1
SCHEMBL3418004 0.81 ELANE (0.66) LMNAMAPTHPGDHTTESR1
SCHEMBL7937271 0.79 MEN1 (0.64) ESR1ESR2ELANEMAPK1MEN1
SCHEMBL7938528 0.79 ESR2 (0.52) ESR1ESR2MEN1KMT2AKDM4E
SCHEMBL3365915 0.78 CA1 (0.54) PKMSRD5A2PPARGPPARAFABP2
SCHEMBL6520817 0.78 ALDH1A1 (0.41) LMNAMAPTHPGDELANEMAPK1
SCHEMBL31012104 0.77 MAPT (0.71) LMNAMAPTHPGDHTTESR1
SCHEMBL10486226 0.77 MAPT (0.71) LMNAMAPTHPGDHTTESR1

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
US-6242654-B1 REACTING A PHENOLATE COMPOUND WITH AN ORGANIC FLUORINATING AGENT TO PREPARE A FLUORINE SUBSTITUTED AROMATIC COMPOUND MITSUI CHEMICALS, INC. (JP) 2001-06-05 US disclosed
EP-1013629-A1 Preparation process of fluorine subsituted aromatic compound Mitsui Chemicals, Inc. (JP) 2000-06-28 EP disclosed