SCHEMBL7342185

SCHEMBL7342185

CN(C(=O)c1ccc(NC(=O)c2ccccc2OCc2ccccc2)cc1)c1ccccc1OCCCCCC(=O)O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SGMS2 Q8NHU3 3/20 0.55
GAA P10253 1/20 0.55
KMT2A Q03164 5/20 0.48
MEN1 O00255 4/20 0.48
ALDH1A1 P00352 1/20 0.46
RAB9A P51151 2/20 0.46
LRRK2 Q5S007 1/20 0.45
MLNR O43193 1/20 0.45
NR1I2 O75469 1/20 0.45
NR3C1 P04150 1/20 0.45
PGR P06401 1/20 0.45
ADRB2 P07550 1/20 0.45
CHRM2 P08172 1/20 0.45
ADRB1 P08588 1/20 0.45
HTR1A P08908 1/20 0.45
ADORA3 P0DMS8 1/20 0.45
CHRM1 P11229 1/20 0.45
DRD2 P14416 1/20 0.45
ADRA2B P18089 1/20 0.45
ADRA2C P18825 1/20 0.45

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
SCHEMBL7337506 0.96 SGMS2 (0.57) SGMS2GAAKMT2AMEN1ALDH1A1
SCHEMBL7342936 0.91 SGMS2 (0.51) SGMS2GAAKMT2AMEN1ALDH1A1
SCHEMBL7348671 0.88 MEN1 (0.48) SGMS2GAAKMT2AMEN1ALDH1A1
SCHEMBL7337754 0.87 BRD4 (0.47) SGMS2GAAKMT2AMEN1ALDH1A1
SCHEMBL7342536 0.87 KMT2A (0.44) KMT2AMEN1ALDH1A1RAB9AMLNR
SCHEMBL7336031 0.87 GAA (0.47) SGMS2GAAKMT2AMEN1LRRK2
SCHEMBL7749374 0.86 GAA (0.47) GAAKMT2AMEN1ALDH1A1RAB9A
SCHEMBL7339794 0.85 GAA (0.47) SGMS2GAAKMT2AMEN1RAB9A
SCHEMBL7363679 0.83 GAA (0.48) SGMS2GAAKMT2AMEN1LRRK2
SCHEMBL7373839 0.83 KMT2A (0.45) GAAKMT2AMEN1ALDH1A1RAB9A

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
US-6054457-A Benzamide derivatives and their use as vasopressin antagonists FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2000-04-25 US disclosed
WO-1996041795-A1 BENZAMIDE DERIVATIVES AND THEIR USE AS VASOPRESSIN ANTAGONISTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1996-12-27 WO disclosed