SCHEMBL7189547

SCHEMBL7189547

Cc1cc(Cc2cc(C)cc(C(C)(C)C)c2C=CC(=O)O)c(C=CC(=O)O)c(C(C)(C)C)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSPA5 P11021 1/20 0.50
SMN1; SMN2 Q16637 4/20 0.49
CYP2C9 P11712 2/20 0.49
CYP2C19 P33261 2/20 0.49
HIF1A Q16665 2/20 0.49
ALDH1A1 P00352 4/20 0.46
CYP2D6 P10635 1/20 0.44
HSD17B10 Q99714 1/20 0.44
CA2 P00918 1/20 0.38
POLB P06746 1/20 0.38
TYR P14679 1/20 0.38
MAPK1 P28482 1/20 0.36
KMT2A Q03164 1/20 0.36
L3MBTL1 Q9Y468 2/20 0.35
GABBR2 O75899 1/20 0.35
GABBR1 Q9UBS5 1/20 0.35
RXRA P19793 1/20 0.35
NR1H4 Q96RI1 1/20 0.35
KDM4E B2RXH2 1/20 0.34
AKR1B10 O60218 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
SCHEMBL4413753 0.93 HSPA5 (0.63) HSPA5SMN1; SMN2CYP2C9CYP2C19HIF1A
SCHEMBL475645 0.93 HSPA5 (0.63) HSPA5SMN1; SMN2CYP2C9CYP2C19HIF1A
SCHEMBL19732823 0.88 HSPA5 (0.49) HSPA5SMN1; SMN2CYP2C9CYP2C19HIF1A
SCHEMBL275967 0.86 SMN1; SMN2 (0.49) HSPA5SMN1; SMN2CYP2C9CYP2C19HIF1A
SCHEMBL7195989 0.85 RXRA (0.40) SMN1; SMN2ALDH1A1HSD17B10MAPK1KMT2A
SCHEMBL7182928 0.82 HSPA5 (0.53) HSPA5SMN1; SMN2HIF1AALDH1A1CYP2D6
SCHEMBL4220907 0.81 SMN1; SMN2 (0.49) HSPA5SMN1; SMN2CYP2C9CYP2C19HIF1A
SCHEMBL3359609 0.80 HSPA5 (0.53) HSPA5SMN1; SMN2CYP2C9CYP2C19HIF1A
SCHEMBL3353518 0.79 HSPA5 (0.44) HSPA5SMN1; SMN2CYP2C9CYP2C19HIF1A
SCHEMBL7200424 0.78 SMN1; SMN2 (0.45) HSPA5SMN1; SMN2ALDH1A1CA2POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6525120-B2 Stabilization using bisphenol ester SUMITOMO CHEMICAL CO., LTD. (JP) 2003-02-25 US disclosed
US-20020002249-A1 Polymer composition SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2002-01-03 US disclosed