SCHEMBL10885407

SCHEMBL10885407

CCCCCCCCCCCCSc1ccc(C(=O)C(C)(C)N2CCOCC2)cc1

nearest known ligand 0.63

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.63
ALDH1A1 P00352 2/20 0.63
TSHR P16473 1/20 0.63
MAPK1 P28482 1/20 0.63
THRB P10828 8/20 0.49
THRA P10827 3/20 0.47
HRH3 Q9Y5N1 1/20 0.47
KDM4E B2RXH2 1/20 0.45
POLB P06746 1/20 0.43
PLK1 P53350 4/20 0.42

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
SCHEMBL9679909 1.00 SMN1; SMN2 (0.63) SMN1; SMN2ALDH1A1TSHRMAPK1THRB
SCHEMBL10649119 0.99 SMN1; SMN2 (0.64) SMN1; SMN2ALDH1A1TSHRMAPK1THRB
SCHEMBL727469 0.95 SMN1; SMN2 (0.66) SMN1; SMN2ALDH1A1TSHRMAPK1THRB
SCHEMBL278825 0.94 SMN1; SMN2 (0.71) SMN1; SMN2ALDH1A1TSHRMAPK1THRB
SCHEMBL17324198 0.90 SMN1; SMN2 (0.69) SMN1; SMN2ALDH1A1TSHRMAPK1THRB
SCHEMBL8168732 0.89 SMN1; SMN2 (0.62) SMN1; SMN2ALDH1A1TSHRMAPK1THRB
SCHEMBL2690853 0.89 SMN1; SMN2 (0.62) SMN1; SMN2ALDH1A1TSHRMAPK1THRB
SCHEMBL10883782 0.89 SMN1; SMN2 (0.74) SMN1; SMN2ALDH1A1TSHRMAPK1HRH3
SCHEMBL8167452 0.88 SMN1; SMN2 (0.63) SMN1; SMN2ALDH1A1TSHRMAPK1THRB
SCHEMBL5822546 0.87 SMN1; SMN2 (0.64) SMN1; SMN2ALDH1A1TSHRMAPK1THRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4582862-A QUICK-SETTING PRINTING INKS BASED ON ACRYLATED RESINS CIBA-GEIGY CORPORATION (US) 1986-04-15 US disclosed