SCHEMBL21952955

SCHEMBL21952955

CC#CC(C)(C)Oc1ccc(C(c2ccc(O)cc2)(C(F)(F)F)C(F)(F)F)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ESR1 P03372 6/20 0.53
▸ ESR2 Q92731 6/20 0.53
▸ KDM4E B2RXH2 1/20 0.41
▸ MEN1 O00255 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ CYP3A4 P08684 2/20 0.35
▸ LMNA P02545 1/20 0.35
▸ TYR P14679 1/20 0.35
▸ AR P10275 1/20 0.35
▸ HPGD P15428 1/20 0.35
▸ TSHR P16473 1/20 0.35
▸ SLC6A2 P23975 1/20 0.35
▸ SLC6A4 P31645 1/20 0.35
▸ HTR6 P50406 1/20 0.35
▸ ESRRG P62508 1/20 0.35
▸ SLC6A3 Q01959 1/20 0.35
▸ HSD17B10 Q99714 1/20 0.35
▸ TRPV1 Q8NER1 2/20 0.33
▸ KIF11 P52732 1/20 0.33
▸ ALDH1A1 P00352 2/20 0.32

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
SCHEMBL23995932 0.83 ESR1 (0.62) ESR1ESR2KDM4EMEN1KMT2A
SCHEMBL24610439 0.79 ESR1 (0.49) ESR1ESR2LMNATYR
SCHEMBL7938037 0.77 ESR1 (0.69) ESR1ESR2KDM4EMEN1KMT2A
SCHEMBL21216068 0.77 ESR1 (0.45) ESR1ESR2KDM4EMEN1KMT2A
SCHEMBL7929177 0.74 ESR1 (0.64) ESR1ESR2KDM4EMEN1KMT2A
SCHEMBL7929343 0.74 ESR2 (0.69) ESR1ESR2KDM4E
SCHEMBL8999933 0.73 ESR1 (0.75) ESR1ESR2MEN1KMT2ALMNA
SCHEMBL3686864 0.73 ESR1 (1.00) ESR1ESR2KDM4EMEN1KMT2A
SCHEMBL4560440 0.73 ESR1 (1.00) ESR1ESR2KDM4EMEN1KMT2A
SCHEMBL21027 0.73 ESR1 (1.00) ESR1ESR2KDM4EMEN1KMT2A

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-10635009-B2 Electrophotographic photosensitive member, process cartridge, and image forming apparatus KYOCERA DOCUMENT SOLUTIONS INC. (JP) 2020-04-28 — — US disclosed
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