SCHEMBL14907498

SCHEMBL14907498

C=CC(=O)OCCCCCCOc1ccc(C(=O)Oc2ccc(CCC3CCC(CCC)CC3)cc2F)cc1

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ FAAH O00519 6/20 0.39
▸ THRB P10828 3/20 0.36
▸ NPC1 O15118 2/20 0.36
▸ LMNA P02545 2/20 0.36
▸ NFKB1 P19838 1/20 0.36
▸ NFKB2 Q00653 1/20 0.36
▸ RELA Q04206 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ MAPT P10636 2/20 0.35
▸ HPGD P15428 1/20 0.34
▸ TSHR P16473 1/20 0.34
▸ HTT P42858 1/20 0.34
▸ CYP1A2 P05177 1/20 0.34
▸ CYP3A4 P08684 1/20 0.34
▸ CYP2D6 P10635 1/20 0.34
▸ CYP2C9 P11712 1/20 0.34
▸ CYP2C19 P33261 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
SCHEMBL14907444 1.00 FAAH (0.39) FAAHTHRBNPC1LMNANFKB1
SCHEMBL14088541 0.95 FAAH (0.40) FAAHTHRBNPC1LMNANFKB1
SCHEMBL14088542 0.93 FAAH (0.41) FAAHTHRBNPC1LMNANFKB1
SCHEMBL14907487 0.89 THRB (0.45) THRBNPC1LMNANFKB1NFKB2
SCHEMBL14907500 0.89 THRB (0.46) FAAHTHRBNPC1LMNANFKB1
SCHEMBL19789528 0.86 FAAH (0.35) FAAHTHRBHPGDTSHR
SCHEMBL14907438 0.84 THRB (0.47) FAAHTHRBNPC1LMNANFKB1
SCHEMBL14907436 0.84 THRB (0.47) FAAHTHRBNPC1LMNANFKB1
SCHEMBL14907439 0.84 TDP1 (0.40) FAAHNPC1LMNANFKB1NFKB2
SCHEMBL14907552 0.84 THRB (0.47) THRBLMNASMN1; SMN2HPGDTSHR

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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