SCHEMBL7368449

SCHEMBL7368449

Cc1ccc(-c2ccccc2C(=O)Nc2ccc(C(=O)N(C)c3ccccc3OCCCN(C)C)cc2)cc1

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.45
ALDH1A1 P00352 2/20 0.45
AVPR2 P30518 2/20 0.45
RECQL P46063 1/20 0.45
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
MAPT P10636 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
NPSR1 Q6W5P4 1/20 0.45
CYP1A2 P05177 1/20 0.45
CYP3A4 P08684 1/20 0.45
CYP2C9 P11712 1/20 0.45
CYP2C19 P33261 1/20 0.45
RXFP1 Q9HBX9 1/20 0.43
MCHR1 Q99705 1/20 0.42
POLB P06746 1/20 0.41
GAA P10253 1/20 0.41
MAPK1 P28482 1/20 0.41
KDR P35968 1/20 0.40

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
SCHEMBL7372435 0.93 RECQL (0.46) ALDH1A1AVPR2RECQLMEN1KMT2A
SCHEMBL7368652 0.93 RECQL (0.48) KDM4EALDH1A1RECQLMEN1KMT2A
SCHEMBL7373554 0.92 RECQL (0.46) ALDH1A1AVPR2RECQLMEN1KMT2A
SCHEMBL7373409 0.91 RECQL (0.45) ALDH1A1AVPR2RECQLMEN1KMT2A
SCHEMBL7368067 0.91 RECQL (0.45) ALDH1A1AVPR2RECQLMEN1KMT2A
SCHEMBL7368424 0.91 RECQL (0.45) ALDH1A1AVPR2RECQLMEN1KMT2A
SCHEMBL7373682 0.90 RECQL (0.44) ALDH1A1AVPR2RECQLMEN1KMT2A
SCHEMBL7377924 0.90 MEN1 (0.46) ALDH1A1RECQLMEN1KMT2AMAPT
SCHEMBL7378355 0.90 RECQL (0.44) ALDH1A1AVPR2RECQLMEN1KMT2A
SCHEMBL7374038 0.89 RECQL (0.43) KDM4EALDH1A1AVPR2RECQLMEN1

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