SCHEMBL7345966

SCHEMBL7345966

O=C(O)c1ccc(NC(=O)c2ccccc2OCc2ccccc2)nc1

nearest known ligand 0.72

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GCK P35557 6/20 0.72
SGMS2 Q8NHU3 4/20 0.70
HCAR3 P49019 1/20 0.59
CXCR2 P25025 1/20 0.58
GAA P10253 1/20 0.58
NPC1 O15118 1/20 0.53
MEN1 O00255 3/20 0.53
KMT2A Q03164 3/20 0.53
LMNA P02545 1/20 0.50
MAPT P10636 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
RARA P10276 1/20 0.50
RARB P10826 1/20 0.50
RARG P13631 1/20 0.50

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
SCHEMBL7348393 0.90 SGMS2 (0.65) GCKSGMS2CXCR2GAANPC1
SCHEMBL5279225 0.84 KMT2A (0.69) GCKHCAR3GAANPC1MEN1
SCHEMBL27613370 0.82 SGMS2 (0.65) GCKSGMS2CXCR2GAANPC1
SCHEMBL8203327 0.82 SGMS2 (0.82) SGMS2GAANPC1MEN1KMT2A
SCHEMBL30322922 0.82 SGMS2 (1.00) SGMS2GAANPC1MEN1KMT2A
SCHEMBL17551827 0.82 SGMS2 (1.00) SGMS2GAANPC1MEN1KMT2A
SCHEMBL5237475 0.81 HCAR3 (0.59) GCKHCAR3CXCR2GAANPC1
SCHEMBL1791977 0.81 GCK (1.00) GCKHCAR3CXCR2MEN1KMT2A
SCHEMBL27437443 0.78 GCK (0.55) GCKHCAR3CXCR2GAAMEN1
SCHEMBL875474 0.77 SGMS2 (1.00) SGMS2GAANPC1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0832061-B1 BENZAMIDE DERIVATIVES AND THEIR USE AS VASOPRESSIN ANTAGONISTS FUJISAWA PHARMACEUTICAL CO (JP) 2001-09-05 EP disclosed
EP-0832061-A1 BENZAMIDE DERIVATIVES AND THEIR USE AS VASOPRESSIN ANTAGONISTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1998-04-01 EP disclosed
WO-1996041795-A1 BENZAMIDE DERIVATIVES AND THEIR USE AS VASOPRESSIN ANTAGONISTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1996-12-27 WO disclosed