SCHEMBL94935

SCHEMBL94935

CCC(C)Nc1ccccc1

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.77
TSHR P16473 4/20 0.77
TDP1 Q9NUW8 3/20 0.77
CYP3A4 P08684 3/20 0.77
ALOX15 P16050 3/20 0.77
HSD17B10 Q99714 3/20 0.77
HIF1A Q16665 2/20 0.77
THRB P10828 2/20 0.77
L3MBTL1 Q9Y468 2/20 0.77
SMN1; SMN2 Q16637 2/20 0.77
TP53 P04637 1/20 0.77
HSP90AA1 P07900 1/20 0.77
CASP1 P29466 1/20 0.77
ALOX12 P18054 2/20 0.57
MAPK1 P28482 1/20 0.57
LMNA P02545 1/20 0.50
RECQL P46063 1/20 0.50
ATM Q13315 1/20 0.50
GAA P10253 1/20 0.44
ELANE P08246 1/20 0.44

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
SCHEMBL13776661 1.00 ALDH1A1 (0.77) ALDH1A1TSHRTDP1CYP3A4ALOX15
SCHEMBL172358 1.00 ALDH1A1 (0.77) ALDH1A1TSHRTDP1CYP3A4ALOX15
SCHEMBL17821990 0.98 ALDH1A1 (0.74) ALDH1A1TSHRTDP1CYP3A4ALOX15
Hydrochloric Acid SCHEMBL17710389 0.98 ALDH1A1 (0.74) ALDH1A1TSHRTDP1CYP3A4ALOX15
Nitrogen SCHEMBL10788887 0.96 ALDH1A1 (0.71) ALDH1A1TSHRTDP1CYP3A4ALOX15
SCHEMBL17822023 0.96 TSHR (0.71) ALDH1A1TSHRTDP1CYP3A4ALOX15
SCHEMBL17046082 0.96 TSHR (0.71) ALDH1A1TSHRTDP1CYP3A4ALOX15
SCHEMBL93902 0.92 ALDH1A1 (0.72) ALDH1A1TSHRTDP1CYP3A4ALOX15
SCHEMBL17046159 0.92 TSHR (0.65) ALDH1A1TSHRTDP1CYP3A4ALOX15
SCHEMBL49805 0.87 ALDH1A1 (1.00) ALDH1A1TSHRTDP1CYP3A4ALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11525098-B2 Fuel additive composition, fuel composition, and process for preparation thereof HINDUSTAN PETROLEUM CORPORATION LIMITED (IN) 2022-12-13 US claimed
CN-110590844-A Preparation method for synthesizing tenofovir alafenamide by two-step method 江西农业大学 2019-12-20 CN claimed
CN-110551153-A Preparation method for synthesizing tenofovir alafenamide by three-step method UNIV JIANGXI AGRICULTURAL 2019-12-10 CN claimed
EP-0172611-B1 EPOXY RESIN CURING AGENT, COMPOSITIONS CONTAINING IT; COATED ABRASIVES MADE THEREWITH AND PROCESS FOR MAKING COATED ABRASIVES MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1990-07-11 EP claimed
US-4062893-A SULFURIC ACID CATALYST NEW JAPAN CHEMICAL COMPANY, LIMITED (JA) 1977-12-13 US claimed
JP-5271560-A None JP disclosed
CN-112368857-B Charge transport composition 日产化学株式会社 2025-06-10 CN disclosed
WO-2025033132-A1 CHARGE-TRANSPORTING VARNISH AND METHOD FOR PRODUCING SAME 日産化学株式会社 2025-02-13 WO disclosed
WO-2025018147-A1 FLUORINATED ARYLSULFONATE POLYMER COMPOUND AND USE OF SAME 日産化学株式会社 2025-01-23 WO disclosed
WO-2024241889-A1 CHARGE-TRANSPORTING VARNISH 日産化学株式会社 2024-11-28 WO disclosed
EP-3911721-B1 FUEL ADDITIVE COMPOSITION, FUEL COMPOSITION, AND PROCESSES FOR PREPARATION THEREOF HINDUSTAN PETROLEUM CORP LTD (IN) 2024-11-20 EP disclosed
CN-118922454-A Polymer and use thereof 日产化学株式会社 2024-11-08 CN disclosed
US-4468526-A Process for the preparation of thiuram disulfides AKZONA INCORPORATED (US) 1984-08-28 US disclosed
EP-0034292-B1 PROCESS FOR THE PREPARATION OF ANTHRANILIC ACID DERIVATIVES F. HOFFMANN-LA ROCHE & CO. Aktiengesellschaft (CH) 1983-11-23 EP disclosed
EP-0031928-B1 PREPARATION OF WATER-IMMISCIBLE, ACID-SOLUBLE N-(AMINOMETHYL)CARBOXAMIDES, QUATERNARY DERIVATIVES AND POLYMERS THEREOF THE DOW CHEMICAL COMPANY (US) 1983-11-23 EP disclosed
US-4357141-A FATTY ACID, BENZYL ALCOHOL, CATIONIC POLYMER L'OREAL (FR) 1982-11-02 US disclosed
US-4301080-A DYES ALSO CONTAINING A PHENYLALKYLAMINO GROUP CIBA-GEIGY CORPORATION (US) 1981-11-17 US disclosed
EP-0031928-A1 Preparation of water-immiscible, acid-soluble N-(aminomethyl)carboxamides, quaternary derivatives and polymers thereof THE DOW CHEMICAL COMPANY (US) 1981-07-15 EP disclosed
US-4247498-A THERMOPLASTICS AKZONA INCORPORATED (US) 1981-01-27 US disclosed
US-4062893-A SULFURIC ACID CATALYST NEW JAPAN CHEMICAL COMPANY, LIMITED (JA) 1977-12-13 US disclosed