SCHEMBL2232697

SCHEMBL2232697

Cc1cc(C(C)(C)C)c(OCC(CO)(CO)CO)c(C(C)(C)C)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.44
ALDH1A1 P00352 2/20 0.44
CA2 P00918 1/20 0.44
POLB P06746 1/20 0.44
TYR P14679 1/20 0.44
CYP2D6 P10635 2/20 0.42
CYP3A4 P08684 2/20 0.42
HSPA5 P11021 1/20 0.41
CYP2C9 P11712 3/20 0.40
CYP2C19 P33261 3/20 0.40
HIF1A Q16665 3/20 0.40
HSD17B10 Q99714 1/20 0.36
MEN1 O00255 1/20 0.33
GMNN O75496 1/20 0.33
GABBR2 O75899 1/20 0.33
LMNA P02545 1/20 0.33
TP53 P04637 1/20 0.33
CYP1A2 P05177 1/20 0.33
ALOX15 P16050 1/20 0.33
TSHR P16473 1/20 0.33

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
SCHEMBL28610704 0.95 CYP2D6 (0.43) SMN1; SMN2ALDH1A1CA2POLBTYR
SCHEMBL3106078 0.95 CYP2D6 (0.43) SMN1; SMN2ALDH1A1CA2POLBTYR
SCHEMBL28706484 0.92 CYP2D6 (0.38) SMN1; SMN2ALDH1A1CA2POLBTYR
Pyrophosphoric Acid SCHEMBL5181896 0.88 HSPA5 (0.36) SMN1; SMN2ALDH1A1CA2POLBTYR
SCHEMBL3106072 0.86 CYP2D6 (0.36) SMN1; SMN2ALDH1A1CA2POLBTYR
SCHEMBL5347930 0.86 RXRA (0.38) ALDH1A1CYP3A4CYP2C9CYP2C19HIF1A
SCHEMBL2163492 0.85 SMN1; SMN2 (0.32) SMN1; SMN2ALDH1A1CA2POLBTYR
SCHEMBL28958829 0.83 CYP3A4 (0.33) SMN1; SMN2ALDH1A1CA2POLBTYR
SCHEMBL27523155 0.83 HSPA5 (0.44) SMN1; SMN2ALDH1A1CYP3A4HSPA5CYP2C9
SCHEMBL27716895 0.81 CYP1A2 (0.41) ALDH1A1CYP2D6CYP3A4CYP2C9CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116063795-B High-gloss high-toughness polypropylene composition and polypropylene material prepared from same 中国石油化工股份有限公司 2024-07-05 CN claimed
CN-116063795-A High-gloss high-toughness polypropylene composition and polypropylene material prepared from same 中国石油化工股份有限公司 2023-05-05 CN claimed
CN-112745497-A Semi-aromatic polyamide resin and preparation method and application thereof 南京开创新材料科技有限公司 2021-05-04 CN claimed
CN-112679728-A Semi-aromatic polyamide resin and preparation method thereof 南京开创新材料科技有限公司 2021-04-20 CN claimed
CN-112063016-B Preparation method of long-acting phosphite ester antioxidant 利安隆(天津)新材料科技有限公司 2021-03-09 CN claimed
CN-112063016-A Preparation method of long-acting phosphite ester antioxidant 利安隆(天津)新材料科技有限公司 2020-12-11 CN claimed
CN-102762658-B Polymer composition MITSUBISHI CHEMICAL EUROPE GMBH (DE) 2016-01-13 CN claimed
CN-102762658-A Polymer composition MITSUBISHI CHEMICAL EUROPE GMBH 2012-10-31 CN claimed
EP-2460856-A1 POLYCARBONATE RESIN COMPOSITION Idemitsu Kosan Co., Ltd. (JP) 2012-06-06 EP claimed
US-7026381-B2 One-piece golf ball SUMITOMO RUBBER INDUSTRIES, LTD. (JP) 2006-04-11 US claimed
US-20040235588-A1 One-piece golf ball SRI SPORTS LIMITED (JP) 2004-11-25 US claimed
US-20040175574-A1 Golf ball SRI SPORTS LIMITED (JP) 2004-09-09 US claimed
JP-1207341-A None JP disclosed
CN-116063795-B High-gloss high-toughness polypropylene composition and polypropylene material prepared from same 中国石油化工股份有限公司 2024-07-05 CN disclosed
CN-118159625-A Flame retardant composition, flame retardant resin composition, and molded article 株式会社ADEKA 2024-06-07 CN disclosed
CN-117999312-A Fluoropolymer-free polymer processing aid 诺瓦化学品(国际)股份有限公司 2024-05-07 CN disclosed
EP-0348829-A2 Nonwoven fabrics IDEMITSU KOSAN COMPANY LIMITED (JP) 1990-01-03 EP disclosed
JP-H01207341-A POLYPROPYLENE COMPOSITION ADEKA ARGUS CHEM CO LTD 1989-08-21 JP disclosed
EP-0324392-A1 Flame-retardant resin composition IDEMITSU KOSAN COMPANY LIMITED (JP) 1989-07-19 EP disclosed
EP-0318793-A1 Styrene-based resin composition IDEMITSU KOSAN COMPANY LIMITED (JP) 1989-06-07 EP disclosed