SCHEMBL279358

SCHEMBL279358

Cc1ccc(-c2nc(C)c(CCON(O)O)s2)c(F)c1F

nearest known ligand 0.34

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TP53 P04637 5/20 0.34
LMNA P02545 4/20 0.33
MAPT P10636 12/20 0.32
FFAR1 O14842 2/20 0.32
THRB P10828 1/20 0.31
PPARD Q03181 2/20 0.31
PPARG P37231 1/20 0.31
PPARA Q07869 1/20 0.31

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
SCHEMBL279517 0.84 LMNA (0.39) TP53LMNAMAPTTHRB
SCHEMBL280498 0.84 MAPT (0.35) TP53LMNAMAPTTHRB
SCHEMBL280310 0.83 MAPT (0.35) TP53LMNAMAPTFFAR1THRB
SCHEMBL280047 0.82 FFAR1 (0.46) TP53LMNAMAPTFFAR1THRB
SCHEMBL279885 0.81 MPL (0.42) TP53LMNAMAPTFFAR1PPARD
SCHEMBL280064 0.80 TP53 (0.33) TP53LMNAMAPTFFAR1THRB
SCHEMBL280036 0.80 CDC7 (0.39) TP53LMNAMAPTTHRB
SCHEMBL280320 0.80 LMNA (0.39) TP53LMNAMAPTFFAR1THRB
SCHEMBL13763088 0.80 CYP1A2 (0.34) TP53LMNAMAPTFFAR1THRB
SCHEMBL12646943 0.79 TP53 (0.42) TP53LMNAMAPTPPARDPPARG

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