SCHEMBL11520757

SCHEMBL11520757

FC(F)(F)c1ccc(-c2sc(-c3ccccc3)cc2-c2ccccc2)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HSD17B1 P14061 2/20 0.58
▸ KIF11 P52732 1/20 0.53
▸ ESR1 P03372 3/20 0.53
▸ ESR2 Q92731 1/20 0.53
▸ HSD17B2 P37059 1/20 0.49
▸ BACE1 P56817 2/20 0.46
▸ MAPT P10636 2/20 0.43
▸ ALDH1A1 P00352 2/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ TDP1 Q9NUW8 1/20 0.43
▸ SNCA P37840 1/20 0.42
▸ S1PR1 P21453 2/20 0.42
▸ ALOX15 P16050 1/20 0.42
▸ S1PR5 Q9H228 1/20 0.42
▸ PTP4A3 O75365 2/20 0.42
▸ TOP1 P11387 1/20 0.42
▸ TSHR P16473 1/20 0.41
▸ MAPK14 Q16539 2/20 0.40
▸ PTP4A2 Q12974 1/20 0.40
▸ PTP4A1 Q93096 1/20 0.40

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
SCHEMBL11523529 0.90 HSD17B1 (0.58) HSD17B1KIF11ESR1ESR2HSD17B2
SCHEMBL11522626 0.87 HSD17B1 (0.54) HSD17B1ESR1ESR2HSD17B2MAPT
SCHEMBL11520987 0.87 HSD17B1 (0.62) HSD17B1KIF11ESR1ESR2HSD17B2
SCHEMBL11520044 0.84 HSD17B1 (0.66) HSD17B1ESR1ESR2HSD17B2BACE1
SCHEMBL9755135 0.84 HSD17B1 (0.70) HSD17B1ESR1ESR2HSD17B2BACE1
SCHEMBL11518665 0.84 HSD17B1 (0.58) HSD17B1ESR1ESR2HSD17B2MAPT
SCHEMBL11522635 0.81 HSD17B1 (0.58) HSD17B1ESR1ESR2HSD17B2PTP4A3
SCHEMBL11524386 0.81 HSD17B1 (0.58) HSD17B1ESR1ESR2HSD17B2PTP4A3
SCHEMBL11522025 0.81 HSD17B1 (0.58) HSD17B1ESR1ESR2HSD17B2PTP4A3
SCHEMBL11522286 0.78 HSD17B1 (0.58) HSD17B1ESR1ESR2HSD17B2MAPT

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4174405-A MITICIDES UNIROYAL, INC. (US) 1979-11-13 — — US disclosed
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