SCHEMBL5787901

SCHEMBL5787901

CN1CCN(OC(=O)c2ccn(C(N)=O)n2)CC1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4C Q9H3R0 1/20 0.37
PARP1 P09874 2/20 0.36
SCN4A P35499 4/20 0.35
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
HPGD P15428 2/20 0.34
SCN9A Q15858 2/20 0.33
KDM4E B2RXH2 3/20 0.32
GLA P06280 1/20 0.32
HTT P42858 1/20 0.32
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
ALDH1A1 P00352 2/20 0.31
HSD17B10 Q99714 1/20 0.31
USP2 O75604 1/20 0.31
PKM P14618 1/20 0.31
HRH4 Q9H3N8 1/20 0.31
PIM1 P11309 1/20 0.31
PIM3 Q86V86 1/20 0.31

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
SCHEMBL28074789 0.73 SCN4A (0.38) SCN4AHPGDSCN9AKDM4EGLA
SCHEMBL5768786 0.70 MEN1 (0.51) SCN4AMEN1KMT2AHPGDKDM4E
SCHEMBL4188566 0.69 SCN4A (0.45) SCN4AKMT2ASCN9AKDM4EHTT
SCHEMBL5592983 0.69 JMJD6 (0.43) SCN4AMEN1KMT2ANPC1RAB9A
SCHEMBL5592954 0.69 JMJD6 (0.44) MEN1KMT2AHPGDSMN1; SMN2
SCHEMBL17066447 0.67 KMT2A (0.55) MEN1KMT2AHPGDNPC1RAB9A
SCHEMBL27827744 0.64 SMN1; SMN2 (0.56) HPGDKDM4EHTTNPC1RAB9A
SCHEMBL6685826 0.63
SCHEMBL9998593 0.63 SCN4A (0.43) PARP1SCN4AKMT2ASCN9AALDH1A1
SCHEMBL9596546 0.62 CYP1A2 (0.44) HPGDHTTALDH1A1

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-1633348-A1 4- BROMO - 5 - (2- CHLORO - BENZOYLAMINO) - 1H - PYRAZOLE - 3 - CARBOXYLIC ACID AMIDE DERIVATIVES AND RELATED COMPOUNDS AS BRADYKININ B sb 1 /sb RECEPTOR ANTAGONISTS FOR THE TREATMENT OF INFLAMMATORY DISEASES Elan Pharmaceuticals, Inc. (US) 2006-03-15 EP disclosed
WO-2004098589-A1 4- BROMO - 5 - (2- CHLORO - BENZOYLAMINO) - 1H - PYRAZOLE - 3 - CARBOXYLIC ACID AMIDE DERIVATIVES AND RELATED COMPOUNDS AS BRADYKININ B1 RECEPTOR ANTAGONISTS FOR THE TREATMENT OF INFLAMMATORY DISEASES ELAN PHARMACEUTICALS, INC. (US) 2004-11-18 WO disclosed