SCHEMBL7182928

SCHEMBL7182928

CCc1cc(Cc2cc(CC)cc(C(C)(C)C)c2C=CC(=O)O)c(C=CC(=O)O)c(C(C)(C)C)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSPA5 P11021 1/20 0.53
PTGS2 P35354 4/20 0.41
RARB P10826 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
ALDH1A1 P00352 2/20 0.35
KMT2A Q03164 3/20 0.35
MEN1 O00255 2/20 0.35
GAA P10253 1/20 0.35
MAPK1 P28482 2/20 0.34
CYP26A1 O43174 1/20 0.34
CYP26B1 Q9NR63 1/20 0.34
PTGS1 P23219 2/20 0.33
GABBR2 O75899 1/20 0.33
GABBR1 Q9UBS5 1/20 0.33
EGFR P00533 1/20 0.33
TBXA2R P21731 4/20 0.32
PTGER3 P43115 4/20 0.32
PTGER2 P43116 4/20 0.32
PTGDR Q13258 4/20 0.32
PTGFR P43088 3/20 0.32

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
SCHEMBL7195989 0.82 RXRA (0.40) RARBSMN1; SMN2ALDH1A1KMT2AMAPK1
SCHEMBL7189547 0.82 HSPA5 (0.50) HSPA5SMN1; SMN2ALDH1A1KMT2AGAA
SCHEMBL7203636 0.81 PTGS2 (0.39) HSPA5PTGS2RARBSMN1; SMN2ALDH1A1
SCHEMBL7191510 0.79 HSPA5 (0.51) HSPA5RARBALDH1A1KMT2AMEN1
SCHEMBL4413753 0.77 HSPA5 (0.63) HSPA5PTGS2SMN1; SMN2ALDH1A1KMT2A
SCHEMBL3353518 0.77 HSPA5 (0.44) HSPA5PTGS2SMN1; SMN2ALDH1A1GAA
SCHEMBL475645 0.77 HSPA5 (0.63) HSPA5PTGS2SMN1; SMN2ALDH1A1KMT2A
SCHEMBL9419399 0.74 HSPA5 (0.63) HSPA5PTGS2SMN1; SMN2ALDH1A1KMT2A
SCHEMBL9419402 0.74 HSPA5 (0.63) HSPA5PTGS2SMN1; SMN2ALDH1A1KMT2A
SCHEMBL275967 0.73 SMN1; SMN2 (0.49) HSPA5SMN1; SMN2ALDH1A1GABBR2GABBR1

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