SCHEMBL10794271

SCHEMBL10794271

c1ccc2sc(SN3CCCCCC3)nc2c1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.73
HPGD P15428 4/20 0.73
HSD17B10 Q99714 3/20 0.73
ALOX15 P16050 2/20 0.73
KDM4E B2RXH2 2/20 0.73
PKM P14618 1/20 0.73
FBP1 P09467 3/20 0.56
TDP1 Q9NUW8 2/20 0.56
ADRA2A P08913 1/20 0.56
ADORA3 P0DMS8 1/20 0.56
DRD2 P14416 1/20 0.56
ADRA2B P18089 1/20 0.56
ADRA2C P18825 1/20 0.56
DRD1 P21728 1/20 0.56
MC5R P33032 1/20 0.56
OPRM1 P35372 1/20 0.56
DRD3 P35462 1/20 0.56
OPRK1 P41145 1/20 0.56
CCR2 P41597 1/20 0.56
HTR6 P50406 1/20 0.56

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
SCHEMBL11545638 1.00 ALDH1A1 (0.73) ALDH1A1HPGDHSD17B10ALOX15KDM4E
SCHEMBL1412338 0.98 ALDH1A1 (0.75) ALDH1A1HPGDHSD17B10ALOX15KDM4E
SCHEMBL30514153 0.98 ALDH1A1 (0.75) ALDH1A1HPGDHSD17B10ALOX15KDM4E
SCHEMBL8203421 0.92 ALDH1A1 (0.79) ALDH1A1HPGDHSD17B10ALOX15KDM4E
SCHEMBL7937684 0.92 ALDH1A1 (0.79) ALDH1A1HPGDHSD17B10ALOX15KDM4E
SCHEMBL28277961 0.86 ALDH1A1 (0.71) ALDH1A1HPGDHSD17B10ALOX15KDM4E
SCHEMBL29404281 0.84 ALDH1A1 (1.00) ALDH1A1HPGDHSD17B10ALOX15KDM4E
SCHEMBL79658 0.84 ALDH1A1 (1.00) ALDH1A1HPGDHSD17B10ALOX15KDM4E
SCHEMBL8516465 0.84 ALDH1A1 (0.62) ALDH1A1HPGDHSD17B10ALOX15KDM4E
SCHEMBL9687490 0.84 ALDH1A1 (0.62) ALDH1A1HPGDHSD17B10ALOX15KDM4E

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 24 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0085710-B1 RUBBER COMPOSITIONS RUBBER RESEARCH ELASTOMERICS INC. (US) 1987-03-18 EP disclosed
US-4481335-A UTILIZATION OF SCRAP RUBBER AS FILLER OR EXTENDER FOR UNCURED RUBBERS VENTURE BANKING GROUP 1984-11-06 US disclosed
EP-0026292-B1 THERMOPLASTIC ELASTOMER BLENDS OF HYDROGENATED POLYBUTADIENE BLOCK COPOLYMERS WITH ALPHA-OLEFIN POLYMERS AND COPOLYMERS AND PROCESS FOR MAKING THESE BLENDS THE FIRESTONE TIRE & RUBBER COMPANY (US) 1984-03-14 EP disclosed
EP-0026293-B1 THERMOPLASTIC ELASTOMER BLENDS OF ALPHA-OLEFIN POLYMERS AND HYDROGENATED 1,2-POLYBUTADIENES AND PROCESS FOR MAKING SAME THE FIRESTONE TIRE & RUBBER COMPANY (US) 1984-02-01 EP disclosed
EP-0085710-A4 RUBBER COMPOSITIONS. RUBBER RES ELASTOMERICS INC (US) 1983-12-23 EP disclosed
US-4419469-A OLEFIN POLYMER, BUTADIENE-STYRENE COPOLYMER THE FIRESTONE TIRE & RUBBER COMPANY (US) 1983-12-06 US disclosed
US-4418167-A BUTADIENE-STYRENE RUBBERS AND 1-O/LEFIN POLYMERS THE FIRESTONE TIRE & RUBBER COMPANY (US) 1983-11-29 US disclosed
EP-0085710-A1 RUBBER COMPOSITIONS. RUBBER RES ELASTOMERICS (US) 1983-08-17 EP disclosed
US-4387175-A OLEFIN POLYMER, BUTADIENE-STYRENE COPOLYMER, PARTIAL CURE THE FIRESTONE TIRE & RUBBER COMPANY (US) 1983-06-07 US disclosed
US-4385142-A Thermoplastic elastomer blends with bitumen THE FIRESTONE TIRE & RUBBER COMPANY (US) 1983-05-24 US disclosed
EP-0040319-A1 Thermoplastic elastomer blends with bitumen THE FIRESTONE TIRE & RUBBER COMPANY (US) 1981-11-25 EP disclosed
EP-0026293-A1 Thermoplastic elastomer blends of alpha-olefin polymers and hydrogenated 1,2-polybutadienes and process for making same THE FIRESTONE TIRE & RUBBER COMPANY (US) 1981-04-08 EP disclosed
EP-0026292-A1 Thermoplastic elastomer blends of hydrogenated polybutadiene block copolymers with alpha-olefin polymers and copolymers and process for making these blends THE FIRESTONE TIRE & RUBBER COMPANY (US) 1981-04-08 EP disclosed
US-4252914-A BLOCK POLYMER OF 1,3- AND 1,2-BUTADIENE; GOOD PHYSICAL PROPERTIES THE FIRESTONE TIRE & RUBBER COMPANY (US) 1981-02-24 US disclosed
US-4250273-A Thermoplastic elastomer blends THE FIRESTONE TIRE & RUBBER COMPANY (US) 1981-02-10 US disclosed
US-4226952-A Thermoplastic elastomer blends of alpha-olefin polymers and hydrogenated medium and high vinyl butadiene polymers THE FIRESTONE TIRE & RUBBER COMPANY (US) 1980-10-07 US disclosed
US-4197377-A GOOD PHYSICAL PROPERTIES, AGING PROPERTIES, PAINT ADHESION; USEFUL FOR AUTOMOBILE PANELS AND BUMPERS THE FIRESTONE TIRE & RUBBER COMPANY (US) 1980-04-08 US disclosed
US-4077924-A Polyester fiber-rubber composites vulcanized with phosphinothioyl amino sulfides MONSANTO COMPANY (US) 1978-03-07 US disclosed
US-4062797-A DITHIOCARBAMATE AMERICAN CYANAMID COMPANY (US) 1977-12-13 US disclosed
US-3947459-A FROM ALKALI SALT OF MERCAPTOTHIAZOLES, AMINES AND BLEACH THE GOODYEAR TIRE & RUBBER COMPANY (US) 1976-03-30 US disclosed