SCHEMBL9216797

SCHEMBL9216797

Nc1cccc(C(c2ccc(O)cc2)(C(F)(F)F)C(F)(F)F)c1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 5/20 0.62
ESR2 Q92731 5/20 0.62
TSHR P16473 1/20 0.53
MAPK1 P28482 1/20 0.53
ALDH1A1 P00352 3/20 0.44
CA14 Q9ULX7 2/20 0.44
CA12 O43570 1/20 0.44
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
CA7 P43166 1/20 0.44
CA9 Q16790 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
PTGS1 P23219 3/20 0.38
KIF11 P52732 1/20 0.37
CYP3A4 P08684 3/20 0.37
CASP1 P29466 2/20 0.37
RECQL P46063 1/20 0.37
CA3 P07451 1/20 0.35
THRB P10828 1/20 0.35
ALOX15 P16050 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
SCHEMBL29492482 0.91 TSHR (0.63) ESR1ESR2TSHRMAPK1ALDH1A1
SCHEMBL201709 0.91 TSHR (0.63) ESR1ESR2TSHRMAPK1ALDH1A1
SCHEMBL205041 0.87 TSHR (0.59) ESR1ESR2TSHRMAPK1ALDH1A1
SCHEMBL7637720 0.87 TSHR (0.59) ESR1ESR2TSHRMAPK1ALDH1A1
SCHEMBL28280787 0.87 ESR1 (0.75) ESR1ESR2TSHRALDH1A1KIF11
SCHEMBL29799449 0.87 TSHR (0.68) ESR1ESR2TSHRMAPK1ALDH1A1
SCHEMBL29373758 0.87 TSHR (0.68) ESR1ESR2TSHRMAPK1ALDH1A1
SCHEMBL10493904 0.87 TSHR (0.68) ESR1ESR2TSHRMAPK1ALDH1A1
SCHEMBL126398 0.87 TSHR (0.68) ESR1ESR2TSHRMAPK1ALDH1A1
SCHEMBL8582903 0.85 TSHR (0.61) ESR1ESR2TSHRMAPK1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0431971-B1 Photosensitive composition and resin-encapsulated semiconductor device TOSHIBA KK (JP) 1995-07-19 EP disclosed
US-5340684-A Polyimidesiloxane copolymers KABUSHIKI KAISHA TOSHIBA (JP) 1994-08-23 US disclosed
EP-0431971-A2 Photosensitive composition and resin-encapsulated semiconductor device KABUSHIKI KAISHA TOSHIBA (JP) 1991-06-12 EP disclosed