SCHEMBL7346648

SCHEMBL7346648

CN1CCN(C(=O)NCCCOc2ccccc2N(C)C(=O)c2ccc(NC(=O)c3ccccc3OCc3ccccc3)cc2)CC1

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.47
SGMS2 Q8NHU3 1/20 0.47
HCN1 O60741 1/20 0.44
HCN4 Q9Y3Q4 1/20 0.44
MET P08581 1/20 0.42
KMT2A Q03164 3/20 0.42
MEN1 O00255 2/20 0.42
POLB P06746 1/20 0.42
LRRK2 Q5S007 2/20 0.41
OPRK1 P41145 1/20 0.41
OPRL1 P41146 1/20 0.41
USP2 O75604 1/20 0.41
MAPT P10636 1/20 0.41
MAPK1 P28482 1/20 0.41
ESR2 Q92731 1/20 0.41
TAAR1 Q96RJ0 1/20 0.41

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
SCHEMBL7347340 0.91 POLB (0.43) KMT2AMEN1POLB
Hydrochloric Acid SCHEMBL7338746 0.90 POLB (0.42) KMT2AMEN1POLB
SCHEMBL7363679 0.89 GAA (0.48) GAASGMS2HCN1HCN4MET
SCHEMBL7368219 0.89 L3MBTL1 (0.45) GAAKMT2AMEN1POLBMAPT
SCHEMBL7335641 0.89 NAMPT (0.41) KMT2AMEN1POLB
SCHEMBL7748299 0.88 NAMPT (0.44) GAAPOLB
SCHEMBL7336031 0.88 GAA (0.47) GAASGMS2HCN1HCN4MET
SCHEMBL7338325 0.87 POLB (0.40) GAAKMT2APOLB
SCHEMBL7373469 0.87 L3MBTL1 (0.40) POLB
SCHEMBL7375729 0.85 AVPR2 (0.41) KMT2AMEN1MAPT

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 4 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
US-6054457-A Benzamide derivatives and their use as vasopressin antagonists FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2000-04-25 US 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