SCHEMBL9219360

SCHEMBL9219360

CCOc1cc2c(c(S(=O)(=O)c3ccc(NC(=O)N(CC)CC)cc3)c1)NC(=O)C2(N)c1ccccc1Cl

nearest known ligand 0.37

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.37
GAA P10253 2/20 0.36
CA12 O43570 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA9 Q16790 1/20 0.36
MAPT P10636 3/20 0.35
TP53 P04637 3/20 0.35
RXFP1 Q9HBX9 1/20 0.35
NAMPT P43490 6/20 0.34
THRB P10828 1/20 0.34
POLB P06746 1/20 0.33
ABCC9 O60706 1/20 0.33
ABCC8 Q09428 1/20 0.33
KCNJ11 Q14654 1/20 0.33
KCNJ8 Q15842 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33

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
SCHEMBL9212742 0.90 NPSR1 (0.41) NPSR1GAACA12CA1CA2
SCHEMBL9215375 0.89 MAPT (0.34) NPSR1GAACA12CA1CA2
SCHEMBL9218931 0.87 NPSR1 (0.37) NPSR1GAACA12CA1CA2
SCHEMBL9221149 0.82 NPSR1 (0.39) NPSR1GAACA12CA1CA2
SCHEMBL9220132 0.79 CA12 (0.35) NPSR1GAACA12CA1CA2
SCHEMBL9221928 0.78 MAPT (0.34) NPSR1GAACA12CA1CA2
SCHEMBL9219789 0.78 NPSR1 (0.41) NPSR1GAACA12CA1CA2
SCHEMBL9219229 0.78 NPSR1 (0.43) NPSR1GAACA12CA1CA2
SCHEMBL9218094 0.77 MAPT (0.35) NPSR1GAACA12CA1CA2
SCHEMBL7472393 0.77 KMT2A (0.42) NPSR1GAACA12CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0687251-A1 1,3-DIHYDROINDOL-2-ONE DERIVATIVES SUBSTITUTED IN POSITION 3 BY A NITROGEN GROUP AS VASOPRESSIN AND/OR OCYTOCINE AGONISTS AND/OR ANTAGONISTS SANOFI (FR) 1995-12-20 EP disclosed