SCHEMBL17484464

SCHEMBL17484464

C=C(C)C(=O)Oc1ccc(-c2ccc(CCO)cc2)cc1

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ELANE P08246 1/20 0.49
PTGS2 P35354 2/20 0.48
KMT2A Q03164 3/20 0.46
ATM Q13315 1/20 0.46
PPARA Q07869 2/20 0.45
THRB P10828 2/20 0.43
CYP4F2 P78329 3/20 0.42
CYP4A11 Q02928 3/20 0.42
HSD17B10 Q99714 1/20 0.39
MEN1 O00255 1/20 0.38
CACNA1B Q00975 1/20 0.38
APBA1 Q02410 1/20 0.38
ACACB O00763 1/20 0.37
ACACA Q13085 1/20 0.37
MAOB P27338 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.36

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
SCHEMBL8266870 0.95 ELANE (0.53) ELANEPTGS2KMT2AATMPPARA
SCHEMBL26362231 0.92 ELANE (0.53) ELANEPTGS2KMT2AATMTHRB
SCHEMBL26362357 0.92 ELANE (0.53) ELANEPTGS2KMT2AATMTHRB
SCHEMBL10020925 0.91 PPARA (0.48) ELANEPTGS2KMT2AATMPPARA
SCHEMBL20827825 0.88 THRB (0.58) ELANEKMT2AATMTHRBACACB
SCHEMBL883697 0.88 THRB (0.58) ELANEKMT2AATMTHRBACACB
SCHEMBL12073934 0.87 ELANE (0.51) ELANEKMT2AATMPPARATHRB
SCHEMBL17791332 0.87 ELANE (0.57) ELANEPTGS2KMT2AATMTHRB
SCHEMBL14555152 0.85 THRB (0.55) ELANEKMT2AATMTHRBHSD17B10
SCHEMBL12092909 0.85 ELANE (0.47) ELANEKMT2AATMTHRBHSD17B10

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-3174955-B1 LIQUID CRYSTALLINE MEDIA HAVING HOMEOTROPIC ALIGNMENT MERCK PATENT GMBH (DE) 2019-10-23 EP disclosed
US-10294426-B2 Liquid crystalline media having homeotropic alignment MERCK PATENT GMBH (DE) 2019-05-21 US disclosed
US-20180208848-A1 LIQUID CRYSTALLINE MEDIA HAVING HOMEOTROPIC ALIGNMENT MERCK PATENT GMBH (DE) 2018-07-26 US disclosed
US-20180208848-A1 LIQUID CRYSTALLINE MEDIA HAVING HOMEOTROPIC ALIGNMENT MERCK PATENT GMBH (DE) 2018-07-26 US disclosed
WO-2016116123-A1 LIGHT MODULATION ELEMENT MERCK PATENT GMBH (DE) 2016-07-28 WO disclosed
WO-2016015803-A1 LIQUID CRYSTALLINE MEDIA HAVING HOMEOTROPIC ALIGNMENT MERCK PATENT GMBH (DE) 2016-02-04 WO disclosed