SCHEMBL10366459

SCHEMBL10366459

CCCCC1Cc2ccccc2O1

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 1/20 0.44
GRM2 Q14416 5/20 0.43
HTR1A P08908 1/20 0.38
HTR1D P28221 1/20 0.38
AOC2 O75106 5/20 0.38
MAOA P21397 5/20 0.38
MAOB P27338 5/20 0.38
POLB P06746 1/20 0.38
ESR2 Q92731 1/20 0.38
DAO P14920 1/20 0.38

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
SCHEMBL2059453 0.95 GRM2 (0.44) HRH3GRM2
SCHEMBL8689028 0.93 GRM2 (0.46) HRH3GRM2
SCHEMBL14862117 0.93 GRM2 (0.46) HRH3GRM2
SCHEMBL13638405 0.89 HRH3 (0.47) HRH3HTR1AHTR1DAOC2MAOA
SCHEMBL8510380 0.83 CA2 (0.50) HTR1AHTR1D
SCHEMBL7271562 0.83 HRH3 (0.44) HRH3HTR1AHTR1DAOC2MAOA
SCHEMBL7270698 0.83 HRH3 (0.44) HRH3HTR1AHTR1DAOC2MAOA
SCHEMBL434338 0.82 HRH3 (0.49) HRH3AOC2MAOAMAOBDAO
SCHEMBL7797530 0.80 HRH3 (0.43) HRH3HTR1AHTR1DAOC2MAOA
SCHEMBL10750642 0.80 SMN1; SMN2 (0.46) HRH3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103320144-B Liquid crystalline cpd containing coumaran and preparation method thereof and application SHIJIAZHUANG CHENGZHI YONGHUA DISPLAY MATERIALS CO., LTD. (CN) 2015-07-29 CN disclosed
EP-2766120-A1 METHOD FOR CATALYTIC HETEROAROMATIC HYDROGENATION Westfälische Wilhelms-Universität Münster (DE) 2014-08-20 EP disclosed
CN-103320144-A Liquid crystal compound containing dihydrobenzofuran and preparation method and application thereof SHIJIAZHUANG CHENGZHI YONGHUA DISPLAY MATERIALS CO LTD 2013-09-25 CN disclosed
WO-2013053796-A1 METHOD FOR CATALYTIC HETEROAROMATIC HYDROGENATION Westfälische Wilhelms Universität Münster (DE) 2013-04-18 WO disclosed
WO-2013053796-A1 METHOD FOR CATALYTIC HETEROAROMATIC HYDROGENATION Westfälische Wilhelms Universität Münster (DE) 2013-04-18 WO disclosed
EP-0207605-B1 HYPOGLYCEMIC THIAZOLIDINEDIONES PFIZER INC. (US) 1990-02-07 EP disclosed
US-4703052-A Hypoglycemic thiazolidinediones PFIZER INC. (US) 1987-10-27 US disclosed
EP-0207605-A1 Hypoglycemic thiazolidinediones PFIZER INC. (US) 1987-01-07 EP disclosed
WO-1986007056-A1 HYPOGLYCEMIC THIAZOLIDINEDIONES PFIZER INC. (US) 1986-12-04 WO disclosed