SCHEMBL7370294

SCHEMBL7370294

CN(C(=O)c1ccccc1)c1ccc(C(=O)N(C)c2ccc(Cl)cc2OCCCCCC(=O)O)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.49
ALDH1A1 P00352 2/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
MAPT P10636 2/20 0.49
NPC1 O15118 1/20 0.49
HTT P42858 1/20 0.49
RAB9A P51151 1/20 0.49
MDM2 Q00987 1/20 0.49
GPR55 Q9Y2T6 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
GAA P10253 1/20 0.48
PPARD Q03181 2/20 0.42
FABP4 P15090 2/20 0.41
EGFR P00533 1/20 0.41
ERBB2 P04626 1/20 0.41
PPARA Q07869 1/20 0.41
MCHR1 Q99705 4/20 0.41
KDM4E B2RXH2 1/20 0.41
MEN1 O00255 1/20 0.41
POLB P06746 1/20 0.41

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
SCHEMBL7373670 0.89 SMN1; SMN2 (0.43) HPGDALDH1A1SMN1; SMN2MAPTNPC1
SCHEMBL7368631 0.89 MCHR1 (0.44) HPGDALDH1A1SMN1; SMN2MAPTNPC1
SCHEMBL7751032 0.86 HPGD (0.52) HPGDALDH1A1SMN1; SMN2MAPTNPC1
SCHEMBL7743982 0.83 ALDH1A1 (0.64) HPGDALDH1A1SMN1; SMN2MAPTNPC1
SCHEMBL7373541 0.81 ALDH1A1 (0.41) HPGDALDH1A1SMN1; SMN2MAPTNPC1
SCHEMBL7377723 0.79 MEN1 (0.44) HPGDALDH1A1SMN1; SMN2MAPTNPC1
SCHEMBL7371570 0.79 MEN1 (0.46) HPGDSMN1; SMN2MAPTFABP4KDM4E
SCHEMBL7375488 0.77 MCHR1 (0.47) ALDH1A1RAB9AL3MBTL1PPARDPPARA
SCHEMBL7369636 0.77 AVPR2 (0.46) HPGDALDH1A1SMN1; SMN2MAPTNPC1
SCHEMBL7377371 0.77 HPGD (0.47) HPGDALDH1A1SMN1; SMN2MAPTNPC1

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