SCHEMBL14907435

SCHEMBL14907435

C=CC(=O)OCCCCCCOc1ccc(-c2ccc(CCc3ccc(Cl)cc3)cc2)c(F)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ S1PR1 P21453 3/20 0.42
▸ S1PR3 Q99500 3/20 0.42
▸ LSS P48449 1/20 0.41
▸ RARB P10826 1/20 0.40
▸ THRB P10828 2/20 0.40
▸ FFAR1 O14842 6/20 0.40
▸ PPARG P37231 2/20 0.40
▸ PPARD Q03181 1/20 0.40
▸ MAOA P21397 1/20 0.39
▸ MAOB P27338 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ CYP3A4 P08684 1/20 0.39
▸ TSHR P16473 1/20 0.39
▸ MCHR1 Q99705 1/20 0.38
▸ PTPN11 Q06124 1/20 0.38
▸ FFAR4 Q5NUL3 5/20 0.38
▸ PRKAB2 O43741 1/20 0.37
▸ PRKAG1 P54619 1/20 0.37
▸ PRKAA2 P54646 1/20 0.37
▸ PRKAA1 Q13131 1/20 0.37

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
SCHEMBL14907433 0.85 LSS (0.41) LSSTHRBFFAR1PPARGALDH1A1
SCHEMBL14907469 0.84 THRB (0.50) S1PR1S1PR3RARBTHRBFFAR1
SCHEMBL23227543 0.83 THRB (0.42) S1PR1S1PR3RARBTHRBFFAR1
SCHEMBL815645 0.82 THRB (0.47) RARBTHRBFFAR1ALDH1A1CYP3A4
SCHEMBL14907495 0.82 THRB (0.50) RARBTHRBFFAR1PPARGPPARD
SCHEMBL14907523 0.81 THRB (0.44) S1PR1S1PR3RARBTHRBFFAR1
SCHEMBL14907443 0.80 S1PR1 (0.46) S1PR1S1PR3RARBTHRBFFAR1
SCHEMBL14088550 0.79 THRB (0.48) RARBTHRBFFAR1ALDH1A1CYP3A4
SCHEMBL803177 0.79 THRB (0.49) S1PR1S1PR3RARBTHRBFFAR1
SCHEMBL19821117 0.79 THRB (0.43) THRBFFAR1ALDH1A1CYP3A4TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2771735-B1 SWITCH ELEMENT COMPRISING A LIQUID CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2018-01-24 — — EP disclosed
US-9507185-B2 Switch element comprising a liquid crystalline medium MERCK PATENT GMBH (DE) 2016-11-29 — — US disclosed
US-9507185-B2 Switch element comprising a liquid crystalline medium MERCK PATENT GMBH (DE) 2016-11-29 — — US disclosed
US-20140293174-A1 SWITCH ELEMENT COMPRISING A LIQUID CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2014-10-02 — — US disclosed
US-20140293174-A1 SWITCH ELEMENT COMPRISING A LIQUID CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2014-10-02 — — US disclosed
WO-2013060406-A1 SWITCH ELEMENT COMPRISING A LIQUID CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2013-05-02 — — WO disclosed
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