SCHEMBL4249242

SCHEMBL4249242

CS(=O)(=O)NCc1ccncn1

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KCNH3 Q9ULD8 1/20 0.40
NAMPT P43490 2/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
KMT2A Q03164 2/20 0.38
MEN1 O00255 1/20 0.37
MALT1 Q9UDY8 1/20 0.37
HPGDS O60760 1/20 0.36
HRH4 Q9H3N8 1/20 0.36
P2RX7 Q99572 1/20 0.36

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
SCHEMBL1706646 0.76 L3MBTL1 (0.65) L3MBTL1KMT2AMEN1
SCHEMBL29681615 0.76 L3MBTL1 (0.65) L3MBTL1KMT2AMEN1
SCHEMBL1272091 0.76 HSP90AA1 (0.40) KCNH3NAMPTHPGDSHRH4P2RX7
SCHEMBL553439 0.75
SCHEMBL2753593 0.74 PRMT1 (0.49) L3MBTL1
SCHEMBL18157948 0.74 KCNH3 (0.47) KCNH3NAMPTHPGDSP2RX7
SCHEMBL2840809 0.73 SMN1; SMN2 (0.59) NAMPTL3MBTL1KMT2A
Hydrochloric Acid SCHEMBL21880022 0.73 KCNH3 (0.44) KCNH3NAMPTHPGDSP2RX7
Hydrochloric Acid SCHEMBL30831440 0.73 KCNH3 (0.44) KCNH3NAMPTHPGDSP2RX7
SCHEMBL4250362 0.73 HDAC3 (0.43) NAMPTL3MBTL1KMT2AMEN1MALT1

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
EP-2049494-A2 TYROSINE KINASE INHIBITORS Merck & Co., Inc. (US) 2009-04-22 EP claimed
WO-2008008310-A2 TYROSINE KINASE INHIBITORS MERCK & CO., INC. (US) 2008-01-17 WO claimed
EP-2049494-A2 TYROSINE KINASE INHIBITORS Merck & Co., Inc. (US) 2009-04-22 EP disclosed
WO-2008008310-A2 TYROSINE KINASE INHIBITORS MERCK & CO., INC. (US) 2008-01-17 WO disclosed
EP-1735284-A1 N-(1-ARYLPYRAZOL-4L)SULFONAMIDES AND THEIR USE AS PARASITICIDES Pfizer Limited (GB) 2006-12-27 EP disclosed
WO-2005090313-A1 N-(1-ARYLPYRAZOL-4L)SULFONAMIDES AND THEIR USE AS PARASITICIDES PFIZER LIMITED (GB) 2005-09-29 WO disclosed