SCHEMBL9751696

SCHEMBL9751696

Oc1ccc(OC2(Oc3ccc(O)cc3)C(F)(F)C(F)(F)C2(F)F)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 3/20 0.44
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
ESR1 P03372 2/20 0.44
LTA4H P09960 3/20 0.38
NR1H2 P55055 1/20 0.38
BAX Q07812 1/20 0.38
LMNA P02545 2/20 0.36
HIF1A Q16665 2/20 0.36
MAPT P10636 2/20 0.36
KDM4E B2RXH2 1/20 0.36
NPC1 O15118 1/20 0.36
CA12 O43570 1/20 0.36
GMNN O75496 1/20 0.36
ALDH1A1 P00352 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA3 P07451 1/20 0.36
CYP3A4 P08684 1/20 0.36
TYR P14679 1/20 0.36

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
SCHEMBL9167809 0.79 ESR2 (0.46) ESR2MEN1KMT2AESR1LTA4H
SCHEMBL9751693 0.74 LMNA (0.52) MEN1KMT2AESR1LMNAMAPT
SCHEMBL9764749 0.74 ALDH1A1 (0.36) KMT2AMAPTALDH1A1CA1CA2
SCHEMBL9175177 0.71 ESR2 (0.55) ESR2MEN1KMT2ALTA4HLMNA
SCHEMBL12833562 0.71 MEN1 (0.38) ESR2MEN1KMT2AESR1LTA4H
SCHEMBL9806660 0.70 ESR2 (0.37) ESR2MEN1KMT2AESR1LTA4H
SCHEMBL22680966 0.69 LMNA (0.54) ESR2MEN1KMT2AESR1LMNA
SCHEMBL12760776 0.68 ESR2 (0.45) ESR2MEN1KMT2AESR1LTA4H
SCHEMBL9391068 0.68 TDP1 (0.38) MEN1KMT2ALMNAMAPTNPC1
SCHEMBL22681006 0.67 PKM (0.56) LMNAMAPTCA12ALDH1A1CA1

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
EP-0428709-A1 REACTIVE COMPOUNDS CONTAINING PERFLUOROVINYL GROUPS. DOW CHEMICAL CO (US) 1991-05-29 EP disclosed
WO-1990015042-A2 REACTIVE COMPOUNDS CONTAINING PERFLUOROVINYL GROUPS THE DOW CHEMICAL COMPANY (US) 1990-12-13 WO disclosed