SCHEMBL1895159

SCHEMBL1895159

CCOc1ccc(OC(=O)C2CCC(CC)CC2)cc1

nearest known ligand 0.55

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.53
HTT P42858 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
TDP1 Q9NUW8 1/20 0.53
USP2 O75604 1/20 0.49
TP53 P04637 1/20 0.49
TSHR P16473 1/20 0.49
F2 P00734 1/20 0.48
ELANE P08246 1/20 0.48
MEN1 O00255 1/20 0.46
PKM P14618 1/20 0.46
ALDH1A1 P00352 1/20 0.44
GAA P10253 1/20 0.44
MAPT P10636 1/20 0.43
ACACB O00763 2/20 0.43
HPGD P15428 1/20 0.43
LMNA P02545 1/20 0.43
PARP10 Q53GL7 1/20 0.42
NQO1 P15559 1/20 0.42

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
SCHEMBL11412276 0.96 KMT2A (0.49) KMT2AHTTSMN1; SMN2TDP1USP2
SCHEMBL12154218 0.92 KMT2A (0.61) KMT2AHTTSMN1; SMN2TDP1F2
SCHEMBL20045170 0.92 KMT2A (0.61) KMT2AHTTSMN1; SMN2TDP1F2
SCHEMBL9117935 0.92 KMT2A (0.61) KMT2AHTTSMN1; SMN2TDP1USP2
SCHEMBL18417199 0.92 KMT2A (0.61) KMT2AHTTSMN1; SMN2TDP1USP2
SCHEMBL7763807 0.88 KMT2A (0.50) KMT2AHTTSMN1; SMN2TDP1USP2
SCHEMBL2213018 0.88 KMT2A (0.50) KMT2AHTTSMN1; SMN2TDP1USP2
SCHEMBL12154151 0.86 HTT (0.54) KMT2AHTTSMN1; SMN2TDP1TSHR
SCHEMBL12444455 0.86 KMT2A (0.54) KMT2AHTTSMN1; SMN2TDP1USP2
SCHEMBL17059002 0.86 KMT2A (0.54) KMT2AHTTSMN1; SMN2TDP1TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2578664-B1 LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY ELEMENT JNC CORP (JP) 2018-04-25 EP disclosed
US-7951577-B2 Liquid crystals with reduced toxicity and applications thereof WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2011-05-31 US disclosed
US-7951577-B2 Liquid crystals with reduced toxicity and applications thereof WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2011-05-31 US disclosed
US-7951577-B2 Liquid crystals with reduced toxicity and applications thereof WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2011-05-31 US disclosed
EP-1731493-B1 BENZENE DERIVATIVE, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY CHISSO CORP (JP) 2011-03-23 EP disclosed
US-20080050799-A1 LIQUID CRYSTALS WITH REDUCED TOXICITY AND APPLICATIONS THEREOF WISCONSIN ALUMNI RESEARCH FOUNDATION 2008-02-28 US disclosed
US-20080050799-A1 LIQUID CRYSTALS WITH REDUCED TOXICITY AND APPLICATIONS THEREOF WISCONSIN ALUMNI RESEARCH FOUNDATION 2008-02-28 US disclosed
US-20080050799-A1 LIQUID CRYSTALS WITH REDUCED TOXICITY AND APPLICATIONS THEREOF WISCONSIN ALUMNI RESEARCH FOUNDATION 2008-02-28 US disclosed
US-7303694-B2 Liquid crystals with reduced toxicity and applications thereof WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2007-12-04 US disclosed
US-7303694-B2 Liquid crystals with reduced toxicity and applications thereof WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2007-12-04 US disclosed
US-7303694-B2 Liquid crystals with reduced toxicity and applications thereof WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2007-12-04 US disclosed
US-20050079487-A1 Liquid crystals with reduced toxicity and applications thereof WISCONSIN ALUMNI RESEARCH FOUNDATION 2005-04-14 US disclosed
WO-2005010160-A2 LIQUID CRYSTALS WITH REDUCED TOXICITY AND APPLICATIONS THEREOF WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2005-02-03 WO disclosed