SCHEMBL28539309

SCHEMBL28539309

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

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.48
ALDH1A1 P00352 4/20 0.48
CA2 P00918 2/20 0.48
POLB P06746 1/20 0.48
TYR P14679 1/20 0.48
HSPA5 P11021 1/20 0.44
CYP2C9 P11712 6/20 0.43
CYP2C19 P33261 6/20 0.43
HIF1A Q16665 4/20 0.43
CYP2D6 P10635 2/20 0.39
HSD17B10 Q99714 1/20 0.39
CYP1A2 P05177 3/20 0.35
TP53 P04637 3/20 0.35
ALOX15 P16050 3/20 0.35
TSHR P16473 2/20 0.35
MEN1 O00255 1/20 0.35
GMNN O75496 1/20 0.35
GABBR2 O75899 1/20 0.35
LMNA P02545 1/20 0.35
CYP3A4 P08684 1/20 0.35

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
SCHEMBL18050603 0.92 SMN1; SMN2 (0.56) SMN1; SMN2ALDH1A1CA2POLBTYR
Butylated Hydroxytoluene SCHEMBL27452988 0.82 SMN1; SMN2 (0.75) SMN1; SMN2ALDH1A1CA2POLBTYR
SCHEMBL3995932 0.78 SMN1; SMN2 (0.47) SMN1; SMN2ALDH1A1CA2POLBTYR
SCHEMBL995276 0.77 SMN1; SMN2 (0.41) SMN1; SMN2ALDH1A1CA2POLBTYR
SCHEMBL28958816 0.74 SMN1; SMN2 (0.36) SMN1; SMN2ALDH1A1CA2POLBTYR
SCHEMBL21753943 0.74 SMN1; SMN2 (0.39) SMN1; SMN2ALDH1A1CA2POLBTYR
SCHEMBL5915880 0.74 GABRA1 (0.42) SMN1; SMN2ALDH1A1CYP2C9CYP2C19CYP1A2
SCHEMBL2679857 0.74 ALDH1A1 (0.46) SMN1; SMN2ALDH1A1CA2POLBTYR
SCHEMBL27759819 0.73 ALDH1A1 (0.52) SMN1; SMN2ALDH1A1CA2POLBTYR
SCHEMBL11250753 0.73 CYP2C19 (0.72) SMN1; SMN2ALDH1A1CA2POLBTYR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112708269-B Halogen-free flame-retardant reinforced semi-aromatic polyamide molding composition with specific glass fiber length and molded product 金发科技股份有限公司 2022-07-08 CN disclosed
CN-114672154-A Semi-aromatic polyamide molding composition for LED 金发科技股份有限公司 2022-06-28 CN disclosed
CN-114133560-A Process for preparing semiaromatic polyamides with improved impact strength, semiaromatic polyamides and moulding compositions 山东广垠新材料有限公司 2022-03-04 CN disclosed
CN-114133559-A Process for preparing semiaromatic polyamides with reduced salt formation cycle, semiaromatic polyamides and moulding compositions 山东广垠新材料有限公司 2022-03-04 CN disclosed
CN-114058010-A Process for preparing low-energy semiaromatic polyamides, semiaromatic polyamides and moulding compositions 山东广垠新材料有限公司 2022-02-18 CN disclosed
CN-114058009-A Process for preparing semi-aromatic polyamides with reduced loss of diamine monomer, semi-aromatic polyamides and molding compositions 山东广垠新材料有限公司 2022-02-18 CN disclosed
CN-114058008-A Process for preparing semi-aromatic polyamides end-capped with monocarboxylic acids, semi-aromatic polyamides and molding compositions 山东广垠新材料有限公司 2022-02-18 CN disclosed
CN-112759923-A Glass fiber reinforced semi-aromatic polyamide molding composition with specific glass fiber length and molded product 金发科技股份有限公司 2021-05-07 CN disclosed
CN-112708269-A Halogen-free flame-retardant reinforced semi-aromatic polyamide molding composition with specific glass fiber length and molded product 金发科技股份有限公司 2021-04-27 CN disclosed
CN-112679948-A Flame-retardant reinforced semi-aromatic polyamide molding composition with specific glass fiber length and molded product 金发科技股份有限公司 2021-04-20 CN disclosed
CN-112601776-A Polyamide and polyamide composition 株式会社可乐丽 2021-04-02 CN disclosed