SCHEMBL7748299

SCHEMBL7748299

CC(C)c1ccccc1C(=O)Nc1ccc(C(=O)N(C)c2ccccc2OCCCNC(=O)N2CCN(C)CC2)cc1

nearest known ligand 0.48

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 10/20 0.44
POLB P06746 1/20 0.42
HTR7 P34969 3/20 0.39
GAA P10253 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
HTR1A P08908 1/20 0.38

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
SCHEMBL7335641 0.91 NAMPT (0.41) NAMPTPOLB
SCHEMBL7368219 0.91 L3MBTL1 (0.45) NAMPTPOLBGAAL3MBTL1
SCHEMBL7347340 0.90 POLB (0.43) NAMPTPOLB
Hydrochloric Acid SCHEMBL7338746 0.89 POLB (0.42) NAMPTPOLB
SCHEMBL7373469 0.89 L3MBTL1 (0.40) NAMPTPOLBL3MBTL1HTR1A
SCHEMBL7346648 0.88 GAA (0.47) POLBGAA
SCHEMBL7375729 0.87 AVPR2 (0.41) NAMPT
SCHEMBL7373631 0.86 NAMPT (0.43) NAMPTPOLBGAA
SCHEMBL7338325 0.86 POLB (0.40) NAMPTPOLBGAAL3MBTL1
SCHEMBL7367751 0.85 AVPR2 (0.40) NAMPT

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
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