SCHEMBL14907440

SCHEMBL14907440

C=CC(=O)OCCCCCCOc1ccc(-c2ccc(CCC3CCC(CCCCC)CC3)cc2F)cc1

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ RARB P10826 2/20 0.43
▸ PTPN11 Q06124 2/20 0.40
▸ S1PR1 P21453 8/20 0.40
▸ S1PR3 Q99500 6/20 0.40
▸ ITGB3 P05106 3/20 0.40
▸ ITGA2B P08514 3/20 0.40
▸ THRB P10828 1/20 0.39
▸ S1PR5 Q9H228 6/20 0.38
▸ RARA P10276 1/20 0.38
▸ HPGD P15428 1/20 0.37
▸ TSHR P16473 1/20 0.37
▸ CNR2 P34972 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
SCHEMBL14907443 0.95 S1PR1 (0.46) RARBPTPN11S1PR1S1PR3ITGB3
SCHEMBL14088541 0.86 FAAH (0.40) ITGB3ITGA2BTHRBTSHR
SCHEMBL14088542 0.83 FAAH (0.41) ITGB3ITGA2BTHRBHPGDTSHR
SCHEMBL14907498 0.81 FAAH (0.39) THRBHPGDTSHR
SCHEMBL14907444 0.81 FAAH (0.39) THRBHPGDTSHR
SCHEMBL14907552 0.81 THRB (0.47) S1PR1S1PR3ITGB3ITGA2BTHRB
SCHEMBL14907523 0.80 THRB (0.44) RARBPTPN11S1PR1S1PR3THRB
SCHEMBL13220826 0.80 ITGB3 (0.49) ITGB3ITGA2BTHRBTSHR
SCHEMBL19789528 0.79 FAAH (0.35) ITGB3ITGA2BTHRBS1PR5HPGD
SCHEMBL1532966 0.79 TSHR (0.48) S1PR3ITGB3ITGA2BTHRBS1PR5

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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