SCHEMBL7335641

SCHEMBL7335641

CN1CCN(C(=O)NCCCOc2ccccc2N(C)C(=O)c2ccc(NC(=O)c3ccccc3O)cc2)CC1

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 10/20 0.41
POLB P06746 1/20 0.40
KDM4E B2RXH2 3/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
NPC1 O15118 1/20 0.40
LMNA P02545 1/20 0.40
TP53 P04637 1/20 0.40
HTT P42858 1/20 0.40
RAB9A P51151 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
ALDH1A1 P00352 2/20 0.38
HPGD P15428 2/20 0.38
HSD17B10 Q99714 2/20 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
SCHEMBL7368219 0.92 L3MBTL1 (0.45) NAMPTPOLBMEN1KMT2ANPC1
SCHEMBL7748299 0.91 NAMPT (0.44) NAMPTPOLB
SCHEMBL7347340 0.90 POLB (0.43) NAMPTPOLBKDM4EMEN1KMT2A
Hydrochloric Acid SCHEMBL7338746 0.90 POLB (0.42) NAMPTPOLBKDM4EMEN1KMT2A
SCHEMBL7373469 0.90 L3MBTL1 (0.40) NAMPTPOLBLMNAALDH1A1
SCHEMBL7346648 0.89 GAA (0.47) POLBMEN1KMT2A
SCHEMBL7345845 0.88 RAB9A (0.42) NAMPTPOLBKDM4EMEN1KMT2A
SCHEMBL7375729 0.88 AVPR2 (0.41) NAMPTKDM4EMEN1KMT2ASMN1; SMN2
SCHEMBL7373631 0.87 NAMPT (0.43) NAMPTPOLBKDM4EKMT2AALDH1A1
SCHEMBL7338325 0.87 POLB (0.40) NAMPTPOLBKDM4EKMT2ANPC1

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
EP-0832061-B1 BENZAMIDE DERIVATIVES AND THEIR USE AS VASOPRESSIN ANTAGONISTS FUJISAWA PHARMACEUTICAL CO (JP) 2001-09-05 EP disclosed
US-6054457-A Benzamide derivatives and their use as vasopressin antagonists FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2000-04-25 US disclosed
WO-1996041795-A1 BENZAMIDE DERIVATIVES AND THEIR USE AS VASOPRESSIN ANTAGONISTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1996-12-27 WO disclosed