SCHEMBL20804523

SCHEMBL20804523

Fc1c(F)c(F)c(-c2cc3sc4cc(-c5ccccc5)sc4c3s2)c(F)c1F

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ IKBKB O14920 3/20 0.37
▸ ESR1 P03372 1/20 0.37
▸ ESR2 Q92731 1/20 0.37
▸ CYP1A1 P04798 1/20 0.36
▸ CYP1B1 Q16678 1/20 0.36
▸ RAB9A P51151 4/20 0.36
▸ MAPT P10636 2/20 0.36
▸ NPC1 O15118 2/20 0.36
▸ SMN1; SMN2 Q16637 2/20 0.36
▸ PTP4A3 O75365 1/20 0.35
▸ PTP4A2 Q12974 1/20 0.35
▸ PTP4A1 Q93096 1/20 0.35
▸ ERCC5 P28715 1/20 0.34
▸ FEN1 P39748 1/20 0.34
▸ MEN1 O00255 2/20 0.33
▸ KMT2A Q03164 2/20 0.33
▸ ALDH1A1 P00352 2/20 0.33
▸ HPGD P15428 2/20 0.33
▸ HSD17B1 P14061 2/20 0.33
▸ HSD17B2 P37059 2/20 0.33

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
SCHEMBL26500458 0.98 IKBKB (0.38) IKBKBESR1ESR2CYP1A1CYP1B1
SCHEMBL26500472 0.97 IKBKB (0.37) IKBKBESR1ESR2CYP1A1CYP1B1
SCHEMBL14225443 0.85 IKBKB (0.46) IKBKBESR1ESR2CYP1A1CYP1B1
SCHEMBL26500481 0.84 TYK2 (0.41) IKBKBRAB9AMAPTNPC1SMN1; SMN2
SCHEMBL20804474 0.83 IKBKB (0.44) IKBKBESR1ESR2CYP1A1CYP1B1
SCHEMBL20804521 0.82 HSD17B1 (0.46) IKBKBESR1ESR2CYP1A1CYP1B1
SCHEMBL20662909 0.81 RAB9A (0.45) IKBKBESR1ESR2CYP1A1CYP1B1
SCHEMBL20662908 0.81 RAB9A (0.45) IKBKBESR1ESR2CYP1A1CYP1B1
SCHEMBL26500563 0.79 CYP1A1 (0.40) IKBKBESR1ESR2CYP1A1CYP1B1
SCHEMBL10053960 0.79 F9 (0.37) IKBKBESR1ESR2CYP1A1CYP1B1

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-20190081251-A1 PHOTOELECTRIC CONVERSION ELEMENT AND SOLID-STATE IMAGING DEVICE SONY CORPORATION (JP) 2019-03-14 — — US disclosed
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