SCHEMBL8562293

SCHEMBL8562293

Cc1cccc2c1Oc1cc(Cl)ccc1NC2

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
MEN1 O00255 2/20 0.38
MAPT P10636 2/20 0.38
KMT2A Q03164 2/20 0.38
KDM4E B2RXH2 2/20 0.38
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38
AHR P35869 3/20 0.35
HRH4 Q9H3N8 3/20 0.34
EGFR P00533 1/20 0.31
AVPR1A P37288 2/20 0.30
ALDH1A1 P00352 1/20 0.30
CASP3 P42574 1/20 0.30
SENP8 Q96LD8 1/20 0.30
SENP7 Q9BQF6 1/20 0.30
SENP6 Q9GZR1 1/20 0.30

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
SCHEMBL8556344 0.78 NPSR1 (0.67) GAANPSR1MEN1MAPTKMT2A
SCHEMBL8559691 0.74 GAA (0.41) GAANPSR1MEN1MAPTKMT2A
SCHEMBL8561406 0.69 MAPT (0.45) GAANPSR1MEN1MAPTKMT2A
SCHEMBL8559836 0.69 MEN1 (0.36) GAANPSR1MEN1MAPTKMT2A
SCHEMBL7885518 0.69 GAA (0.67) GAANPSR1MEN1MAPTKMT2A
SCHEMBL8561609 0.69 GAA (0.62) GAANPSR1MEN1MAPTKMT2A
SCHEMBL8556950 0.67 NOX1 (0.41) GAAMEN1MAPTKMT2ANPC1
SCHEMBL6970933 0.66 NPSR1 (0.67) GAANPSR1MEN1MAPTKMT2A
SCHEMBL8563763 0.66 NPSR1 (0.67) GAANPSR1MEN1MAPTKMT2A
SCHEMBL8559100 0.64 GAA (0.54) GAANPSR1MEN1MAPTKMT2A

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
EP-0640592-B1 N-acylated tricyclic azaheterorings useful as vasopressin antagonists AMERICAN CYANAMID CO (US) 1998-12-30 EP disclosed
EP-0640592-A1 N-acylated tricyclic azaheterorings useful as vasopressin antagonists AMERICAN CYANAMID COMPANY (US) 1995-03-01 EP disclosed