SCHEMBL10552014

SCHEMBL10552014

Cn1c(=O)[nH]c2cc3[nH]c(-c4ccc(N)cc4)nc3cc21

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 8/20 0.55
KMT2A Q03164 8/20 0.55
ALDH1A1 P00352 8/20 0.55
MAPT P10636 8/20 0.55
SMN1; SMN2 Q16637 7/20 0.55
KDM4E B2RXH2 7/20 0.55
POLB P06746 6/20 0.55
HPGD P15428 6/20 0.55
GLA P06280 5/20 0.55
NFKB1 P19838 3/20 0.55
HSD17B10 Q99714 3/20 0.55
RECQL P46063 2/20 0.55
PKM P14618 2/20 0.55
USP2 O75604 2/20 0.55
BLM P54132 2/20 0.55
GMNN O75496 1/20 0.55
CYP3A4 P08684 1/20 0.55
THRB P10828 1/20 0.55
APEX1 P27695 1/20 0.55
MAPK1 P28482 1/20 0.55

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
SCHEMBL10555484 0.87 LMNA (0.51) ALDH1A1MAPTSMN1; SMN2HPGDHSD17B10
SCHEMBL10553046 0.87 LMNA (0.51) MEN1KMT2AALDH1A1MAPTSMN1; SMN2
SCHEMBL10553294 0.86 LMNA (0.52) ALDH1A1MAPTKDM4EHPGDHSD17B10
SCHEMBL10553321 0.85 LMNA (0.52) MEN1KMT2AALDH1A1MAPTSMN1; SMN2
SCHEMBL10550172 0.83 NPC1 (0.60) MEN1KMT2AALDH1A1MAPTSMN1; SMN2
SCHEMBL10551608 0.82 LMNA (0.49) MEN1KMT2AALDH1A1MAPTSMN1; SMN2
SCHEMBL10553748 0.81 ALDH1A1 (0.58) MEN1KMT2AALDH1A1MAPTSMN1; SMN2
SCHEMBL10556108 0.81 LMNA (0.49) MEN1KMT2AALDH1A1MAPTSMN1; SMN2
SCHEMBL10554631 0.80 LMNA (0.49) ALDH1A1MAPTSMN1; SMN2KDM4EHPGD
SCHEMBL10551194 0.80 LMNA (0.48) MEN1KMT2AALDH1A1MAPTSMN1; SMN2

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
US-4831032-A CARDIOVASCULAR DISORDERS, HYPOTENSIVE, ISOTROPIC AGENTS BOEHRINGER MANNHEIM GMBH (DE) 1989-05-16 US disclosed
EP-0207483-A2 Benzimidazoles, process for their preparation, medicaments containing them and intermediates Roche Diagnostics GmbH (DE) 1987-01-07 EP disclosed