SCHEMBL7200424

SCHEMBL7200424

Cc1cc(C(C)c2cc(C)cc(C(C)(C)C)c2C=CC(=O)O)c(C=CC(=O)O)c(C(C)(C)C)c1

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.45
ALDH1A1 P00352 3/20 0.45
CA2 P00918 1/20 0.37
POLB P06746 1/20 0.37
TYR P14679 1/20 0.37
MAPK1 P28482 2/20 0.35
KMT2A Q03164 1/20 0.35
KDM4E B2RXH2 1/20 0.34
GABBR2 O75899 1/20 0.34
GABBR1 Q9UBS5 1/20 0.34
RXRA P19793 1/20 0.34
NR1H4 Q96RI1 1/20 0.34
NPC1 O15118 1/20 0.33
GAA P10253 1/20 0.33
HSPA5 P11021 1/20 0.32
TNFRSF1A P19438 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
SCHEMBL809463 0.93 SMN1; SMN2 (0.42) SMN1; SMN2ALDH1A1CA2POLBTYR
SCHEMBL7200672 0.85 CYP3A4 (0.37) SMN1; SMN2ALDH1A1MAPK1KMT2AKDM4E
SCHEMBL7203636 0.82 PTGS2 (0.39) SMN1; SMN2ALDH1A1CA2MAPK1KMT2A
SCHEMBL4153743 0.80 CYP2C9 (0.42) SMN1; SMN2ALDH1A1CA2POLBTYR
SCHEMBL809386 0.80 CYP1A2 (0.44) SMN1; SMN2ALDH1A1GABBR2GABBR1RXRA
SCHEMBL4157787 0.79 CYP1A2 (0.39) SMN1; SMN2ALDH1A1MAPK1KMT2AKDM4E
SCHEMBL8781594 0.79 SMN1; SMN2 (0.37) SMN1; SMN2ALDH1A1CA2POLBTYR
SCHEMBL7205602 0.78 SMN1; SMN2 (0.36) SMN1; SMN2ALDH1A1CA2POLBTYR
SCHEMBL7189547 0.78 HSPA5 (0.50) SMN1; SMN2ALDH1A1CA2POLBTYR
SCHEMBL4220907 0.77 SMN1; SMN2 (0.49) 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 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