SCHEMBL278642

SCHEMBL278642

Cc1nc(-c2cc(F)c(Cl)cc2Cl)sc1CCON(O)O

nearest known ligand 0.37

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.37
TP53 P04637 5/20 0.37
PTPN1 P18031 5/20 0.33
LMNA P02545 3/20 0.33
THRB P10828 1/20 0.32
ALPL P05186 3/20 0.32
S1PR1 P21453 1/20 0.31
FFAR1 O14842 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
SCHEMBL280036 0.85 CDC7 (0.39) MAPTTP53PTPN1LMNATHRB
SCHEMBL280323 0.85 LMNA (0.39) MAPTTP53PTPN1LMNATHRB
SCHEMBL280310 0.83 MAPT (0.35) MAPTTP53PTPN1LMNATHRB
SCHEMBL280320 0.83 LMNA (0.39) MAPTTP53PTPN1LMNATHRB
SCHEMBL280465 0.83 MAPT (0.47) MAPTTP53PTPN1LMNATHRB
SCHEMBL10205601 0.82 MAPT (0.46) MAPTTP53PTPN1LMNATHRB
SCHEMBL280047 0.81 FFAR1 (0.46) MAPTTP53LMNATHRBFFAR1
SCHEMBL280290 0.81 MAPT (0.39) MAPTTP53PTPN1LMNATHRB
SCHEMBL264090 0.80 MAPT (0.36) MAPTTP53PTPN1LMNATHRB
SCHEMBL280064 0.79 TP53 (0.33) MAPTTP53LMNATHRBFFAR1

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