SCHEMBL7375680

SCHEMBL7375680

Cc1ccc(-c2ccccc2C(=O)Nc2ccc(C(=O)N(C)c3ccccc3OCCCCNC(=O)Oc3ccccc3)cc2)cc1

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
MAPT P10636 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
GAA P10253 2/20 0.40
POLB P06746 1/20 0.40
RECQL P46063 1/20 0.40
KDM4E B2RXH2 3/20 0.38
ALDH1A1 P00352 2/20 0.38
HPGD P15428 1/20 0.37
HSD17B10 Q99714 1/20 0.37
FAAH O00519 3/20 0.36
RAB9A P51151 1/20 0.36

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
SCHEMBL7373144 0.99 MEN1 (0.41) MEN1KMT2AMAPTNPSR1CYP1A2
SCHEMBL7374117 0.98 MEN1 (0.42) MEN1KMT2AMAPTNPSR1CYP1A2
SCHEMBL7375925 0.88 MTTP (0.40) MAPTGAAALDH1A1
SCHEMBL7373196 0.88 MTTP (0.40) MEN1KMT2AMAPTKDM4EALDH1A1
SCHEMBL7514980 0.87 MCHR1 (0.43) MEN1KMT2AGAAPOLBKDM4E
SCHEMBL7373554 0.87 RECQL (0.46) MEN1KMT2AMAPTNPSR1CYP1A2
SCHEMBL7375063 0.87 ALDH1A1 (0.36) MEN1KMT2AMAPTNPSR1KDM4E
SCHEMBL7377885 0.87 MTTP (0.43) MEN1KMT2AGAAKDM4EALDH1A1
SCHEMBL7369738 0.86 MEN1 (0.46) MEN1KMT2AMAPTNPSR1CYP1A2
SCHEMBL7373409 0.86 RECQL (0.45) MEN1KMT2AMAPTNPSR1CYP1A2

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
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
WO-1995029152-A1 BENZAMIDE DERIVATIVES AS VASOPRESSIN ANTAGONISTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1995-11-02 WO disclosed