SCHEMBL9218026

SCHEMBL9218026

CCN(CC)C(=O)Nc1ccc(S(=O)(=O)c2cc(Cl)cc3c2NC(=O)C3(NC2CCNCC2)c2ccccc2Cl)cc1

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.39
GAA P10253 1/20 0.38
ABCC9 O60706 1/20 0.33
ABCC8 Q09428 1/20 0.33
KCNJ11 Q14654 1/20 0.33
KCNJ8 Q15842 1/20 0.33
NAMPT P43490 9/20 0.33
HTR6 P50406 4/20 0.33
CA12 O43570 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA9 Q16790 1/20 0.32
MAPT P10636 1/20 0.31
SSTR1 P30872 1/20 0.31
SSTR4 P31391 1/20 0.31
MAOA P21397 1/20 0.30

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
SCHEMBL9212184 0.91 NPSR1 (0.35) NPSR1GAAABCC9ABCC8KCNJ11
SCHEMBL9211583 0.89 NPSR1 (0.34) NPSR1GAAABCC9ABCC8KCNJ11
SCHEMBL9219229 0.88 NPSR1 (0.43) NPSR1GAAABCC9ABCC8KCNJ11
SCHEMBL9215077 0.83 NPSR1 (0.41) NPSR1GAAABCC9ABCC8KCNJ11
SCHEMBL9219701 0.83 NPSR1 (0.38) NPSR1GAAABCC9ABCC8KCNJ11
SCHEMBL9209710 0.82 NPSR1 (0.39) NPSR1GAAABCC9ABCC8KCNJ11
SCHEMBL9215385 0.82 NPSR1 (0.37) NPSR1GAAABCC9ABCC8KCNJ11
SCHEMBL9217130 0.82 NPSR1 (0.37) NPSR1GAAABCC9ABCC8KCNJ11
SCHEMBL9219789 0.82 NPSR1 (0.41) NPSR1GAAABCC9ABCC8KCNJ11
SCHEMBL9212742 0.82 NPSR1 (0.41) NPSR1GAAABCC9ABCC8KCNJ11

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