SCHEMBL9814925

SCHEMBL9814925

CCC(=O)SCC(CCC(=O)O)C(=O)O

nearest known ligand 0.56

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 14/20 0.56
CPB2 Q96IY4 1/20 0.44
GRM3 Q14832 2/20 0.43
NAALAD2 Q9Y3Q0 1/20 0.43

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
SCHEMBL9814774 0.87 FOLH1 (0.50) FOLH1CPB2GRM3NAALAD2
SCHEMBL9814843 0.81 CPB2 (0.59) FOLH1CPB2GRM3NAALAD2
SCHEMBL9814740 0.78 FOLH1 (0.48) FOLH1CPB2GRM3NAALAD2
SCHEMBL9814660 0.76 FOLH1 (0.50) FOLH1CPB2GRM3NAALAD2
SCHEMBL9814887 0.76 FOLH1 (0.61) FOLH1GRM3NAALAD2
SCHEMBL28305853 0.74 FOLH1 (0.58) FOLH1GRM3NAALAD2
SCHEMBL1722576 0.73 FOLH1 (0.62) FOLH1GRM3NAALAD2
SCHEMBL3446776 0.72 CA2 (0.65) FOLH1GRM3
SCHEMBL108166 0.72 FOLH1 (0.76) FOLH1GRM3NAALAD2
SCHEMBL21295970 0.72 FOLH1 (0.58) FOLH1

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-4927966-A ANTITUMOR THE RESEARCH FOUNDATION OF STATE UNIVERSITY OF NEW YORK (US) 1990-05-22 US claimed
US-5010103-A Anticarcinogenic agents THE RESEARCH FOUNDATION OF STATE UNIVERSITY OF N.Y. (US) 1991-04-23 US disclosed
US-4927966-A ANTITUMOR THE RESEARCH FOUNDATION OF STATE UNIVERSITY OF NEW YORK (US) 1990-05-22 US disclosed