SCHEMBL7474353

SCHEMBL7474353

O=C1NCCN1c1ccc2c(c1)CCNCC2

nearest known ligand 0.51

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 11/20 0.51
HTR2C P28335 9/20 0.43
HTR2B P41595 7/20 0.43
HTR2A P28223 1/20 0.43

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
SCHEMBL15939888 0.89 TSHR (0.47) HTR6
SCHEMBL22144682 0.82 HTR6 (0.46) HTR6
SCHEMBL7478863 0.74 NR1H2 (0.54)
SCHEMBL20929543 0.74 HTR6 (0.55) HTR6
SCHEMBL24380324 0.74 BCAT2 (0.53) HTR6HTR2CHTR2BHTR2A
SCHEMBL22144444 0.73 DDB1 (0.53) HTR6
SCHEMBL26684149 0.73 DDB1 (0.53) HTR6
SCHEMBL30450133 0.73 DDB1 (0.53) HTR6
SCHEMBL30201617 0.73 DDB1 (0.53) HTR6
SCHEMBL11492352 0.72 CYP11B2 (0.49)

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0777667-A1 CYCLIC BENZAZEPINE UREA DERIVATIVES WITH AGGREGATION-INHIBITING EFFECT Dr. Karl Thomae GmbH (DE) 1997-06-11 EP claimed
WO-1996005194-A1 CYCLIC BENZAZEPINE UREA DERIVATIVES WITH AGGREGATION-INHIBITING EFFECT DR. KARL THOMAE GMBH (DE) 1996-02-22 WO claimed
EP-0777667-A1 CYCLIC BENZAZEPINE UREA DERIVATIVES WITH AGGREGATION-INHIBITING EFFECT Dr. Karl Thomae GmbH (DE) 1997-06-11 EP disclosed
WO-1996005194-A1 CYCLIC BENZAZEPINE UREA DERIVATIVES WITH AGGREGATION-INHIBITING EFFECT DR. KARL THOMAE GMBH (DE) 1996-02-22 WO disclosed