SCHEMBL7478474

SCHEMBL7478474

C=CCC(=O)[N]c1ccccc1CC=C

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 2/20 0.40
GABRB2 P47870 2/20 0.40
KDM4E B2RXH2 10/20 0.35
MEN1 O00255 5/20 0.34
KMT2A Q03164 5/20 0.34
HTT P42858 3/20 0.34
SMN1; SMN2 Q16637 3/20 0.34
MAPT P10636 2/20 0.34
LMNA P02545 2/20 0.34
ALOX12 P18054 1/20 0.34
ALDH1A1 P00352 6/20 0.34
HSD17B10 Q99714 5/20 0.34
GAA P10253 3/20 0.33
NPC1 O15118 1/20 0.33
POLB P06746 1/20 0.33
RAB9A P51151 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
HPGD P15428 1/20 0.33

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
SCHEMBL28246060 0.74 GABRA1 (0.42) GABRA1GABRB2KDM4EMEN1KMT2A
SCHEMBL11555510 0.74 GABRA1 (0.45) GABRA1GABRB2KDM4EMEN1KMT2A
SCHEMBL1362962 0.73 CYP3A4 (0.40) KDM4EMEN1KMT2AHTTSMN1; SMN2
SCHEMBL14321847 0.72 GABRA1 (0.44) GABRA1GABRB2KDM4EMEN1KMT2A
SCHEMBL3646580 0.72 GABRA1 (0.40) GABRA1GABRB2KDM4EMEN1KMT2A
SCHEMBL11171966 0.72 GABRA1 (0.44) GABRA1GABRB2MEN1KMT2AMAPT
SCHEMBL3164440 0.71 GABRA1 (0.41) GABRA1GABRB2KDM4EMEN1KMT2A
SCHEMBL7775721 0.71 GABRA1 (0.42) GABRA1GABRB2KDM4EMEN1KMT2A
SCHEMBL3806685 0.71 GABRA1 (0.42) GABRA1GABRB2KDM4EMEN1KMT2A
SCHEMBL9816019 0.70 GABRA1 (0.43) GABRA1GABRB2KDM4EMEN1KMT2A

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