SCHEMBL29757181

SCHEMBL29757181

Cc1cc(-c2c(Cl)ccc3[nH]nnc23)c(O)c(C(C)(C)C)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.41
ALDH1A1 P00352 1/20 0.41
CA2 P00918 1/20 0.41
POLB P06746 1/20 0.41
TYR P14679 1/20 0.41
HSPA5 P11021 1/20 0.35
CYP2C9 P11712 3/20 0.35
CYP2C19 P33261 3/20 0.35
HIF1A Q16665 3/20 0.35
TP53 P04637 1/20 0.33
F2 P00734 1/20 0.32
F10 P00742 1/20 0.32
PLG P00747 1/20 0.32
PLAU P00749 1/20 0.32
PRSS1 P07477 1/20 0.32
CYP2D6 P10635 1/20 0.32
HSD17B10 Q99714 1/20 0.32
AMY1A P0DUB6 1/20 0.31
PTGS1 P23219 1/20 0.31
PTGS2 P35354 1/20 0.31

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
SCHEMBL170449 1.00 SMN1; SMN2 (0.41) SMN1; SMN2ALDH1A1CA2POLBTYR
SCHEMBL29429258 1.00 SMN1; SMN2 (0.41) SMN1; SMN2ALDH1A1CA2POLBTYR
SCHEMBL29470088 0.88 HSP90AA1 (0.41) SMN1; SMN2CYP2C9CYP2C19HIF1ATP53
SCHEMBL2356488 0.88 HSP90AA1 (0.41) SMN1; SMN2CYP2C9CYP2C19HIF1ATP53
SCHEMBL29733675 0.88 HSP90AA1 (0.41) SMN1; SMN2CYP2C9CYP2C19HIF1ATP53
SCHEMBL28203169 0.85 TP53 (0.31) SMN1; SMN2CYP2C9CYP2C19HIF1ATP53
SCHEMBL30162803 0.84 SMN1; SMN2 (0.41) SMN1; SMN2ALDH1A1CA2POLBTYR
SCHEMBL1925757 0.84 GABBR2 (0.32) PTGS1PTGS2
SCHEMBL27880219 0.84 TP53 (0.33) SMN1; SMN2ALDH1A1CYP2C9CYP2C19HIF1A
SCHEMBL31621073 0.84 TRPA1 (0.31)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240199811-A1 OPTICALLY TRANSPARENT POLYAMIDE-IMIDES ZYMERGEN INC (US) 2024-06-20 US disclosed
CN-114932729-A Decorative sheet and decorative material using same 大日本印刷株式会社 2022-08-23 CN disclosed
CN-109890613-B Decorative sheet and decorative material using same 大日本印刷株式会社 2022-07-22 CN disclosed