SCHEMBL7368737

SCHEMBL7368737

CCOC(=O)CCCCCOc1ccccc1N(C)C(=O)c1ccc(NC(=O)c2ccccc2-c2ccccc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.43
ALDH1A1 P00352 6/20 0.43
LMNA P02545 2/20 0.43
GAA P10253 3/20 0.43
POLB P06746 1/20 0.43
KMT2A Q03164 4/20 0.43
MEN1 O00255 3/20 0.42
AVPR2 P30518 2/20 0.42
MLNR O43193 1/20 0.42
NR1I2 O75469 1/20 0.42
NR3C1 P04150 1/20 0.42
PGR P06401 1/20 0.42
ADRB2 P07550 1/20 0.42
CHRM2 P08172 1/20 0.42
ADRB1 P08588 1/20 0.42
HTR1A P08908 1/20 0.42
ADORA3 P0DMS8 1/20 0.42
CHRM1 P11229 1/20 0.42
DRD2 P14416 1/20 0.42
ADRA2B P18089 1/20 0.42

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
SCHEMBL7376574 0.95 AVPR2 (0.42) RAB9AALDH1A1LMNAGAAKMT2A
SCHEMBL7374760 0.94 AVPR2 (0.43) RAB9AALDH1A1LMNAGAAKMT2A
SCHEMBL7372350 0.92 AVPR2 (0.43) RAB9AALDH1A1LMNAGAAKMT2A
SCHEMBL7749374 0.90 GAA (0.47) RAB9AALDH1A1GAAPOLBKMT2A
SCHEMBL7374905 0.89 AVPR2 (0.41) RAB9AALDH1A1GAAPOLBKMT2A
SCHEMBL7373910 0.89 AVPR2 (0.41) RAB9AALDH1A1GAAPOLBKMT2A
SCHEMBL7373461 0.88 RECQL (0.42) RAB9AALDH1A1GAAPOLBKMT2A
SCHEMBL7376897 0.88 RECQL (0.42) RAB9AALDH1A1GAAPOLBKMT2A
SCHEMBL7335672 0.88 KMT2A (0.44) RAB9AALDH1A1LMNAGAAKMT2A
SCHEMBL7342936 0.87 SGMS2 (0.51) RAB9AALDH1A1LMNAGAAKMT2A

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
US-6211242-B1 CARDIOVASCULAR DISORDERS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2001-04-03 US disclosed
EP-0757670-B1 BENZAMIDE DERIVATIVES AS VASOPRESSIN ANTAGONISTS FUJISAWA PHARMACEUTICAL CO (JP) 1999-01-13 EP disclosed
EP-0757670-A1 BENZAMIDE DERIVATIVES AS VASOPRESSIN ANTAGONISTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1997-02-12 EP disclosed
WO-1995029152-A1 BENZAMIDE DERIVATIVES AS VASOPRESSIN ANTAGONISTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1995-11-02 WO disclosed