SCHEMBL7337605

SCHEMBL7337605

CN(C(=O)c1ccc(C(=O)c2ccccc2OCCCNC(=O)OC(C)(C)C)c(O)c1N)C1CCCCC1

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.41
TRPM8 Q7Z2W7 1/20 0.40
KMT2A Q03164 3/20 0.39
MEN1 O00255 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
HPGD P15428 1/20 0.39
TSHR P16473 1/20 0.39
GAA P10253 1/20 0.39
ALDH1A1 P00352 1/20 0.38
LMNA P02545 1/20 0.38
CA12 O43570 2/20 0.37
CA1 P00915 2/20 0.37
CA2 P00918 2/20 0.37
CA9 Q16790 2/20 0.37
DRD2 P14416 4/20 0.36
HSD11B1 P28845 1/20 0.35
THRB P10828 1/20 0.35
SCN9A Q15858 1/20 0.34
IDH1 O75874 1/20 0.34

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
SCHEMBL7345858 0.89 KMT2A (0.41) MAPTTRPM8KMT2AMEN1SMN1; SMN2
SCHEMBL7342126 0.89 TRPM8 (0.47) MAPTTRPM8KMT2AMEN1SMN1; SMN2
SCHEMBL7345623 0.87 MAPT (0.41) MAPTTRPM8KMT2AMEN1SMN1; SMN2
SCHEMBL7337600 0.78 RXFP1 (0.38) MAPTKMT2AMEN1SMN1; SMN2HPGD
SCHEMBL7345667 0.75 DRD2 (0.37) KMT2AMEN1SMN1; SMN2HPGDCA12
SCHEMBL7345849 0.74 MAPT (0.37) MAPTKMT2AMEN1SMN1; SMN2GAA
SCHEMBL7342119 0.73 SGMS2 (0.46) TRPM8KMT2AMEN1SMN1; SMN2GAA
SCHEMBL7337033 0.73 SIGMAR1 (0.39) MAPTKMT2AMEN1SMN1; SMN2HPGD
SCHEMBL7337773 0.72 IDO1 (0.37) MAPTKMT2AMEN1SMN1; SMN2HPGD
SCHEMBL7345615 0.72 MAPT (0.38) MAPTKMT2AMEN1SMN1; SMN2TSHR

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