SCHEMBL9497679

SCHEMBL9497679

CCCOC(=O)c1ccsc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.58
ALDH1A1 P00352 4/20 0.56
TSHR P16473 3/20 0.56
ESR1 P03372 2/20 0.56
CHRM1 P11229 1/20 0.56
SLC6A2 P23975 1/20 0.56
KDR P35968 1/20 0.56
TDP1 Q9NUW8 1/20 0.56
ELANE P08246 2/20 0.55
CES2 O00748 1/20 0.48
CES1 P23141 1/20 0.48
ADORA2B P29275 1/20 0.48
LCK P06239 1/20 0.47
FYN P06241 1/20 0.47
DAO P14920 1/20 0.47
POLB P06746 2/20 0.46
KDM4E B2RXH2 1/20 0.46
STS P08842 1/20 0.46
HPGD P15428 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.45

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
SCHEMBL9494666 0.90 ESR1 (0.58) LMNAALDH1A1TSHRESR1TDP1
SCHEMBL1183367 0.89 CES2 (0.56) LMNAALDH1A1TSHRESR1CHRM1
SCHEMBL9499078 0.88 ALDH1A1 (0.56) LMNAALDH1A1TSHRESR1STS
SCHEMBL13610198 0.87 ALDH1A1 (0.59) LMNAALDH1A1TSHRESR1STS
SCHEMBL9301569 0.87 ALDH1A1 (0.59) LMNAALDH1A1TSHRESR1STS
SCHEMBL15702300 0.87 ALDH1A1 (0.59) LMNAALDH1A1TSHRESR1STS
SCHEMBL827404 0.85 ELANE (0.53) LMNAALDH1A1TSHRESR1TDP1
Hydrochloric Acid SCHEMBL30166750 0.84 ELANE (0.52) LMNAALDH1A1TSHRESR1TDP1
SCHEMBL7254758 0.82 CES2 (0.48) LMNAALDH1A1TSHRESR1CHRM1
SCHEMBL18668815 0.79 TDP1 (0.49) LMNAALDH1A1TSHRESR1TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2014202857-A1 ACTIVE LAYER MADE OF METAL COMPLEXES ON A POROUS CONDUCTIVE SUBSTRATE WITH LARGE SPECIFIC SURFACE AREA, MANUFACTURING METHOD AND USE AS CATHODE FOR ELECTROREDUCTION OF CARBON DIOXIDE IFP Energies Nouvelles (FR) 2014-12-24 WO claimed
WO-2014202854-A1 METHOD OF PRODUCING FORMIC ACID BY ELECTROCATALYTIC REDUCTION IN THE GASEOUS PHASE OF THE CO2 IFP Energies Nouvelles (FR) 2014-12-24 WO disclosed
WO-2014202857-A1 ACTIVE LAYER MADE OF METAL COMPLEXES ON A POROUS CONDUCTIVE SUBSTRATE WITH LARGE SPECIFIC SURFACE AREA, MANUFACTURING METHOD AND USE AS CATHODE FOR ELECTROREDUCTION OF CARBON DIOXIDE IFP Energies Nouvelles (FR) 2014-12-24 WO disclosed
EP-0267794-B1 PROCESS FOR PREPARING POLYOLEFINS Nippon Petrochemicals Co., Ltd. (JP) 1993-05-05 EP disclosed
EP-0267794-A2 Process for preparing polyolefins Nippon Petrochemicals Co., Ltd. (JP) 1988-05-18 EP disclosed
US-4711742-A Solution processible forms of neutral and electrically conductive poly(substituted heterocycles) ALLIED CORPORATION (US) 1987-12-08 US disclosed
EP-0203438-A1 Solution processible forms of neutral and electrically conductive poly(substituted heterocycles) ALLIED CORPORATION (US) 1986-12-03 EP disclosed
US-4525555-A TITANIUM COMPOUND SUPPORTED ON SOLID REACTION PRODUCT OF MAGNESIUM HALIDE, SILOXANES, ORGANIC COMPOUNDS NIPPON OIL COMPANY, LIMITED (JP) 1985-06-25 US disclosed