SCHEMBL21753943

SCHEMBL21753943

CCCCC(O)c1c(C(C)(C)C)cc(C)cc1C(C)(C)C.OCC(CO)(CO)CO

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.39
ALDH1A1 P00352 2/20 0.39
CA2 P00918 1/20 0.39
POLB P06746 1/20 0.39
TYR P14679 1/20 0.39
HSPA5 P11021 1/20 0.37
CYP2C9 P11712 3/20 0.36
CYP2C19 P33261 3/20 0.36
HIF1A Q16665 2/20 0.36
CYP2D6 P10635 2/20 0.35
TP53 P04637 1/20 0.35
ALOX15 P16050 1/20 0.35
GAA P10253 1/20 0.34
XBP1 P17861 1/20 0.34
ATM Q13315 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
HSD17B10 Q99714 1/20 0.33
ADRB2 P07550 4/20 0.31
KDM4E B2RXH2 1/20 0.30

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
SCHEMBL28173898 0.84 ATM (0.33) ALDH1A1CYP2C9CYP2C19HIF1ACYP2D6
SCHEMBL1101463 0.79 SMN1; SMN2 (0.40) SMN1; SMN2ALDH1A1CA2POLBTYR
SCHEMBL1100187 0.78 SMN1; SMN2 (0.41) SMN1; SMN2ALDH1A1CA2POLBTYR
SCHEMBL28223262 0.76 GAA (0.35) ALDH1A1CA2HSPA5CYP2C9CYP2C19
SCHEMBL7943784 0.74 GAA (0.33) SMN1; SMN2ALDH1A1CA2POLBTYR
SCHEMBL28539309 0.74 SMN1; SMN2 (0.48) SMN1; SMN2ALDH1A1CA2POLBTYR
SCHEMBL1100570 0.73 SMN1; SMN2 (0.44) SMN1; SMN2ALDH1A1CA2POLBTYR
SCHEMBL28958848 0.73 GAA (0.31) GAAXBP1ATMNPSR1L3MBTL1
SCHEMBL1101462 0.73 SMN1; SMN2 (0.37) SMN1; SMN2ALDH1A1CA2POLBTYR
SCHEMBL6055210 0.72 ADRB2 (0.37) ALDH1A1POLBNPSR1ADRB2KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114672154-B Semi-aromatic polyamide molding composition for LED 金发科技股份有限公司 2024-04-02 CN disclosed
CN-114133560-B Process for the preparation of semiaromatic polyamides with improved impact strength, semiaromatic polyamides and moulding compositions 山东广垠新材料有限公司 2024-03-08 CN disclosed
CN-113677497-B Impact-modified injection-molded polyamides 奥升德功能材料运营有限公司 2024-02-23 CN disclosed
CN-113677754-B Hydrolysis resistant polyamide 奥升德功能材料运营有限公司 2024-01-16 CN disclosed
CN-114058009-B Process for the preparation of semi-aromatic polyamides with reduced diamine monomer loss, semi-aromatic polyamides and molding compositions 山东广垠新材料有限公司 2023-11-10 CN disclosed
CN-115209730-A Antimicrobial/antiviral plastics and molded products 奥升德功能材料运营有限公司 2022-10-18 CN disclosed
CN-115209738-A Antiviral article 奥升德功能材料运营有限公司 2022-10-18 CN disclosed
CN-108966653-B Heat-aging-resistant low-halogen flame-retardant polyamide composition 奥升德高性能材料公司 2022-06-21 CN disclosed
CN-113677754-A Hydrolysis resistant polyamides 奥升德功能材料运营有限公司 2021-11-19 CN disclosed
CN-113677497-A Impact-modified injection-molded polyamides 奥升德功能材料运营有限公司 2021-11-19 CN disclosed
WO-2020238440-A1 SEMI-AROMATIC POLYAMIDE, METHOD FOR SYNTHESIS THEREOF, AND POLYAMIDE MOLDING COMPOSITION CONSISTING THEREOF 金发科技股份有限公司 2020-12-03 WO disclosed
WO-2020040282-A1 POLYAMIDE AND POLYAMIDE COMPOSITION 株式会社クラレ 2020-02-27 WO disclosed