SCHEMBL279546

SCHEMBL279546

Cc1ccc(-c2nc(C)c(CCON(O)O)s2)cc1C

nearest known ligand 0.46

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MAPT P10636 15/20 0.46
LMNA P02545 8/20 0.46
THRB P10828 2/20 0.46
POLB P06746 1/20 0.45
TP53 P04637 8/20 0.42
RXFP1 Q9HBX9 1/20 0.41

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
SCHEMBL280312 0.85 MAPT (0.47) MAPTLMNATHRBTP53
SCHEMBL280158 0.85 MAPT (0.41) MAPTLMNATHRBTP53
SCHEMBL10206606 0.84 MAPT (0.52) MAPTLMNAPOLBTP53RXFP1
SCHEMBL279195 0.83 MAPT (0.41) MAPTLMNATHRBTP53
SCHEMBL10207171 0.83 MAPT (0.49) MAPTLMNATHRBPOLBTP53
SCHEMBL278857 0.83 LMNA (0.48) MAPTLMNATHRBTP53
SCHEMBL280465 0.82 MAPT (0.47) MAPTLMNATHRBTP53
SCHEMBL279899 0.82 PTGDR2 (0.44) MAPTLMNATHRBTP53
SCHEMBL13763088 0.82 CYP1A2 (0.34) MAPTLMNATHRBTP53
SCHEMBL279881 0.82 CDC7 (0.47) MAPTLMNATHRBPOLBTP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8134010-B2 4-[4-Methyl-5-(2-nitrooxy-ethyl)-thiazol-2-yl]-phenylamine; N-{4-[4-Methyl-5-(2-nitrooxy-ethyl)-thiazol-2-yl]-phenyl}-acetamide; or4-Methyl-5-(2-nitrooxy-ethyl)-2-(4-nitro-phenyl)-thiazole; cardiovascular, gastrointestinal, inflammatory, respiratory disease RENOPHARM LTD. (IL) 2012-03-13 US disclosed
US-7968575-B2 Nitric oxide donors and uses thereof RENOPHARM LTD. (IL) 2011-06-28 US disclosed
US-7579477-B2 Thiazole-based nitric oxide donors having alkyl substituent(s) and uses thereof RENOPHARM LTD. (IL) 2009-08-25 US disclosed
US-7498445-B2 Thiazole-based nitric oxide donors capable of releasing two or more nitric oxide molecules and uses thereof RENOPHARM LTD. (IL) 2009-03-03 US disclosed
US-7368577-B2 Thiazole-based nitric oxide donors having aryl substituent(s) and uses thereof RENOPHARM LTD. (IL) 2008-05-06 US disclosed
US-7332513-B2 Thiazole-based nitric oxide donors having acyl substituent(s) and uses thereof RENOPHARM LTD. (IL) 2008-02-19 US disclosed