SCHEMBL7369948

SCHEMBL7369948

CCOC(=O)CCCCCOc1cc(Cl)ccc1N(C)C(=O)c1ccc(NC(=O)c2ccccc2-c2ccc(C)cc2)c(OC)c1

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MTTP P55157 6/20 0.39
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 2/20 0.38
HPGD P15428 2/20 0.38
F10 P00742 5/20 0.38
AVPR2 P30518 3/20 0.37
AVPR1A P37288 2/20 0.37
AVPR1B P47901 2/20 0.37

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
SCHEMBL7377966 0.94 MTTP (0.41) MTTPALDH1A1HPGDAVPR2AVPR1A
SCHEMBL7369305 0.93 F10 (0.39) KDM4EALDH1A1HPGDF10AVPR2
SCHEMBL7519200 0.92 MTTP (0.42) MTTPKDM4EALDH1A1HPGDF10
SCHEMBL7371186 0.92 AVPR2 (0.42) MTTPALDH1A1AVPR2AVPR1AAVPR1B
SCHEMBL7372866 0.90 MAPT (0.42) KDM4EALDH1A1HPGDF10AVPR2
SCHEMBL7376314 0.88 MTTP (0.42) MTTPKDM4EALDH1A1HPGD
SCHEMBL7374507 0.88 MAPT (0.43) MTTPKDM4EALDH1A1HPGD
SCHEMBL7369597 0.87 MEN1 (0.39) ALDH1A1HPGDAVPR2AVPR1AAVPR1B
SCHEMBL7372148 0.87 MTTP (0.44) MTTPALDH1A1HPGDAVPR2AVPR1A
SCHEMBL7749369 0.87 AVPR2 (0.49) MTTPALDH1A1HPGDAVPR2AVPR1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0757670-B1 BENZAMIDE DERIVATIVES AS VASOPRESSIN ANTAGONISTS FUJISAWA PHARMACEUTICAL CO (JP) 1999-01-13 EP disclosed
WO-1995029152-A1 BENZAMIDE DERIVATIVES AS VASOPRESSIN ANTAGONISTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1995-11-02 WO disclosed