SCHEMBL7938528

SCHEMBL7938528

Oc1ccc(-c2ccc(OC(Cl)(Cl)Cl)cc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 6/20 0.52
ESR1 P03372 7/20 0.50
MMP3 P08254 1/20 0.48
BCL2L1 Q07817 1/20 0.48
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
KDM4E B2RXH2 1/20 0.42
ABL1 P00519 4/20 0.42
ABCB1 P08183 4/20 0.42
BCR P11274 4/20 0.42
HSD17B1 P14061 1/20 0.41
HSD17B2 P37059 1/20 0.41
KIF11 P52732 1/20 0.41
APP P05067 1/20 0.38

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 0.93 ESR2 (0.50) ESR2ESR1MEN1KMT2AKDM4E
SCHEMBL7937271 0.86 MEN1 (0.64) ESR2ESR1MEN1KMT2AKDM4E
SCHEMBL7929131 0.81 ESR1 (0.56) ESR2ESR1MEN1KMT2AKDM4E
SCHEMBL7938025 0.81 NR1H2 (0.56) ESR2ESR1MEN1KMT2AKDM4E
SCHEMBL10712854 0.80 MEN1 (0.34) MEN1KMT2AKDM4E
SCHEMBL7940897 0.79 LMNA (0.58) ESR2ESR1MMP3MEN1KMT2A
SCHEMBL7937266 0.79 ESR2 (0.61) ESR2ESR1MEN1KMT2AKDM4E
SCHEMBL7937242 0.78 MEN1 (0.37) ESR2ESR1MEN1KMT2AKDM4E
SCHEMBL7940688 0.78 PKM (0.59) ESR2ESR1MEN1KMT2AKDM4E
SCHEMBL3417993 0.77 ESR2 (0.58) ESR2ESR1MMP3BCL2L1MEN1

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