SCHEMBL7439033

SCHEMBL7439033

COc1cc(=O)c2ccccc2n(CC(=O)OCc2ccccc2)c1=O

nearest known ligand 0.64

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 8/20 0.64
LMNA P02545 4/20 0.64
RAB9A P51151 1/20 0.54
KDM4E B2RXH2 2/20 0.46
MAPT P10636 4/20 0.44
MAPK1 P28482 2/20 0.44
KMT2A Q03164 3/20 0.43
MEN1 O00255 2/20 0.42
ALDH1A1 P00352 2/20 0.42
TSHR P16473 1/20 0.41
HTT P42858 1/20 0.41
TP53 P04637 1/20 0.41

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
SCHEMBL18171802 0.79 SMN1; SMN2 (0.61) SMN1; SMN2LMNARAB9AKDM4EMAPK1
SCHEMBL12611486 0.78 GLA (0.62) SMN1; SMN2LMNARAB9AKDM4EMAPK1
SCHEMBL18171828 0.77 SMN1; SMN2 (0.63) SMN1; SMN2LMNAKDM4EMAPTKMT2A
SCHEMBL7482859 0.74 RAB9A (0.46) SMN1; SMN2LMNARAB9AKDM4EMAPT
SCHEMBL7199062 0.73 SMN1; SMN2 (0.49) SMN1; SMN2LMNAMAPTKMT2AMEN1
SCHEMBL7814763 0.73 HDAC1 (0.51) SMN1; SMN2MAPTMAPK1TP53
SCHEMBL11999986 0.70 KDM4E (0.67) SMN1; SMN2LMNARAB9AKDM4EMAPT
SCHEMBL5320439 0.70 ALDH1A1 (0.58) SMN1; SMN2LMNAMAPK1KMT2AMEN1
SCHEMBL5324208 0.70 ALDH1A1 (0.67) SMN1; SMN2LMNAKDM4EMAPK1KMT2A
SCHEMBL11999961 0.70 KDM4E (0.74) RAB9AKDM4EMAPTMAPK1KMT2A

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
US-4575503-A ANGIOTENSIN CONVERTING ENZYME INHIBITOR, HYPOTENSIVE CIBA-GEIGY CORPORATION (US) 1986-03-11 US disclosed
US-4473575-A ANGIOTENSIN INHIBITORS, HYPOTENSIVE AGENTS CIBA-GEIGY CORPORATION (US) 1984-09-25 US disclosed
US-4410520-A ANGIOTENSION CONVERTING ENZYME INGIBITOR, HYPOTENSIVE AGENTS CIBA-GEIGY CORPORATION (US) 1983-10-18 US disclosed
EP-0072352-A1 Benzazepin-2-ones, process for their preparation, pharmaceutical preparations containing these compounds and the compounds for therapeutical use CIBA-GEIGY AG (CH) 1983-02-16 EP disclosed