SCHEMBL13680415

SCHEMBL13680415

CON(C)C(=O)c1cccnc1Sc1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.55
ALDH1A1 P00352 6/20 0.52
GAA P10253 1/20 0.52
ATM Q13315 1/20 0.51
KMT2A Q03164 1/20 0.50
L3MBTL1 Q9Y468 3/20 0.43
PKM P14618 2/20 0.43
KDM4E B2RXH2 1/20 0.42
LMNA P02545 1/20 0.42
TSHR P16473 1/20 0.40
CASP3 P42574 1/20 0.40
RAB9A P51151 1/20 0.40
SENP8 Q96LD8 1/20 0.40
SENP7 Q9BQF6 1/20 0.40
SENP6 Q9GZR1 1/20 0.40

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
SCHEMBL14502540 0.88 ALDH1A1 (0.54) SMN1; SMN2ALDH1A1GAAKMT2AL3MBTL1
SCHEMBL11489686 0.79 SIRT1 (0.54) ALDH1A1KMT2AL3MBTL1
SCHEMBL2295833 0.78 ALDH1A1 (0.74) SMN1; SMN2ALDH1A1GAAATMKMT2A
Hydrochloric Acid SCHEMBL7110024 0.76 ALDH1A1 (0.77) SMN1; SMN2ALDH1A1GAAATMKMT2A
SCHEMBL1092652 0.75 TRPM8 (0.42) SMN1; SMN2ALDH1A1L3MBTL1PKMKDM4E
SCHEMBL307472 0.75 P2RX7 (0.50) SMN1; SMN2ALDH1A1L3MBTL1KDM4ELMNA
SCHEMBL5087696 0.75 SMN1; SMN2 (0.61) SMN1; SMN2ALDH1A1GAAATMKMT2A
SCHEMBL7110016 0.75 SMN1; SMN2 (0.61) SMN1; SMN2ALDH1A1GAAATMKMT2A
SCHEMBL781008 0.75 NAPRT (0.56) SMN1; SMN2ALDH1A1KMT2AL3MBTL1KDM4E
SCHEMBL257468 0.74 LMNA (0.54) SMN1; SMN2KMT2AL3MBTL1PKMLMNA

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-7582664-B2 Acylaminothiazole derivatives, preparation method thereof and use of same in therapeutics SANOFI-AVENTIS (FR) 2009-09-01 US disclosed
US-7582664-B2 Acylaminothiazole derivatives, preparation method thereof and use of same in therapeutics SANOFI-AVENTIS (FR) 2009-09-01 US disclosed