SCHEMBL4336625

SCHEMBL4336625

C#Cc1ccc(F)cc1F.Oc1ccc(-c2ccc(O)cc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 9/20 0.47
ESR1 P03372 10/20 0.42
ESRRB O95718 1/20 0.40
ESRRA P11474 1/20 0.40
KIF11 P52732 1/20 0.40
AR P10275 1/20 0.39
ABL1 P00519 1/20 0.38
ABCB1 P08183 1/20 0.38
BCR P11274 1/20 0.38
CYP11B1 P15538 1/20 0.37
CYP11B2 P19099 1/20 0.37
CA3 P07451 1/20 0.36
CA6 P23280 1/20 0.36
CA5A P35218 1/20 0.36
CA9 Q16790 1/20 0.36
CA14 Q9ULX7 1/20 0.36
CA5B Q9Y2D0 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
DHODH Q02127 1/20 0.35

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
SCHEMBL15596489 0.89 ESR1 (0.51) ESR2ESR1ESRRBESRRAKIF11
SCHEMBL30111761 0.84 ALDH1A1 (0.42) ARCYP11B1CYP11B2CA3CA6
SCHEMBL434666 0.84 ALDH1A1 (0.42) ARCYP11B1CYP11B2CA3CA6
SCHEMBL412535 0.71 ESR1 (0.55) ESR2ESR1CA3CA6CA5A
SCHEMBL19859678 0.71 ESR1 (0.42) ESR2ESR1CYP11B1CYP11B2
SCHEMBL411329 0.71 ESR1 (0.69) ESR2ESR1KIF11ABL1ABCB1
SCHEMBL9468496 0.71 ESR1 (0.69) ESR2ESR1KIF11ABL1ABCB1
SCHEMBL2786094 0.70 AR (0.62) ESR2ESR1KIF11ARCYP11B1
SCHEMBL27604202 0.70 ESR2 (0.48) ESR2ESR1CYP11B1CYP11B2CA3
SCHEMBL11409765 0.69 ALOX5 (0.56) ESR2ESR1ESRRBESRRAABL1

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-8487070-B2 Sulfonated poly(arylene ether) having crosslinkable moiety combined in chain of polymer, sulfonated poly(arylene ether) having crosslinkable moieties combined in polymer and at polymer end group, and polymer electrolyte membrane using sulfonated poly(arylene ether) GWANGJU INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2013-07-16 US disclosed
US-20090233146-A1 SULFONATED POLY(ARYLENE ETHER) HAVING CROSSLINKABLE MOIETY COMBINED IN CHAIN OF POLYMER, SULFONATED POLY(ARYLENE ETHER) HAVING CROSSLINKABLE MOIETIES COMBINED IN POLYMER AND AT POLYMER END GROUP, AND POLYMER ELECTROLYTE MEMBRANE USING SULFONATED POLY(ARYLENE ETHER) GWANGJU INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2009-09-17 US disclosed