SCHEMBL15732306

SCHEMBL15732306

Cc1ccccc1P(c1ccccc1C(F)(F)F)c1ccccc1C(F)(F)F

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 5/20 0.38
AR P10275 3/20 0.35
TDP1 Q9NUW8 4/20 0.35
ALDH1A1 P00352 3/20 0.35
KDM4E B2RXH2 1/20 0.35
GAA P10253 1/20 0.35
ATM Q13315 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
TSHR P16473 2/20 0.35
ACHE P22303 2/20 0.35
POLB P06746 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
MEN1 O00255 1/20 0.34
CYP1A2 P05177 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2D6 P10635 1/20 0.34
CYP2C19 P33261 1/20 0.34
KMT2A Q03164 1/20 0.34
SCN8A Q9UQD0 1/20 0.34
ALOX12 P18054 1/20 0.34

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
SCHEMBL5087451 0.87 ALDH1A1 (0.41) HSD11B1TDP1ALDH1A1GAATSHR
SCHEMBL15732509 0.87 ATM (0.36) HSD11B1ARTDP1ALDH1A1KDM4E
SCHEMBL15732580 0.85 HSD11B1 (0.42) HSD11B1ARTDP1ALDH1A1KDM4E
SCHEMBL15661102 0.85 ALDH1A1 (0.40) HSD11B1TDP1ALDH1A1GAATSHR
SCHEMBL15732447 0.82 HSD11B1 (0.38) HSD11B1TDP1ALDH1A1TSHRPOLB
SCHEMBL15748686 0.82 GABRA1 (0.45) TDP1ALDH1A1TSHRACHE
SCHEMBL15732375 0.80 HSD11B1 (0.35) HSD11B1ARTRPA1TRPM8TRPV1
SCHEMBL29357701 0.80 TSHR (0.53) TDP1ALDH1A1TSHRACHECYP1A2
SCHEMBL4480 0.80 TSHR (0.53) TDP1ALDH1A1TSHRACHECYP1A2
SCHEMBL3127305 0.80 TSHR (0.53) TDP1ALDH1A1TSHRACHECYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2735581-B1 COMPOSITION AND POLYMER ASAHI CHEMICAL IND (JP) 2021-07-14 EP disclosed
US-9738757-B2 Composition and polymer ASAHI KASEI CHEMICALS CORPORATION (JP) 2017-08-22 US disclosed
US-20160222168-A1 Composition and Polymer ASAHI KASEI CHEMICALS CORPORATION (JP) 2016-08-04 US disclosed
US-9334371-B2 Composition and polymer ASAHI KASEI CHEMICALS CORPORATION (JP) 2016-05-10 US disclosed
EP-2735581-A1 COMPOSITION AND POLYMER Asahi Kasei Chemicals Corporation (JP) 2014-05-28 EP disclosed