SCHEMBL7594673

SCHEMBL7594673

CCOC(=O)CN1C(=O)C(NC(=O)OC(C)(C)C)CC(=O)C2CCCCC21

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.36
ABL1 P00519 1/20 0.36
RIN1 Q13671 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
GAA P10253 1/20 0.36
F2 P00734 1/20 0.35
F10 P00742 1/20 0.35
PRSS1 P07477 1/20 0.35
ALDH1A1 P00352 4/20 0.35
TP53 P04637 1/20 0.35
PDE4A P27815 1/20 0.34
PDE4B Q07343 1/20 0.34
PDE4C Q08493 1/20 0.34
PDE4D Q08499 1/20 0.34
NAAA Q02083 2/20 0.34
LMNA P02545 2/20 0.34
MAPT P10636 2/20 0.34
MEN1 O00255 1/20 0.34
TSHR P16473 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34

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
SCHEMBL7594680 1.00 KMT2A (0.36) KMT2AABL1RIN1TDP1GAA
SCHEMBL7570993 0.84 F2 (0.38) KMT2AABL1RIN1TDP1GAA
SCHEMBL10907327 0.84 F2 (0.38) KMT2AABL1RIN1TDP1GAA
SCHEMBL7594567 0.82 F2 (0.36) KMT2AABL1RIN1TDP1GAA
SCHEMBL7594570 0.82 F2 (0.36) KMT2AABL1RIN1TDP1GAA
SCHEMBL7902399 0.78 ALDH1A1 (0.40) KMT2AABL1RIN1TDP1GAA
SCHEMBL7902401 0.78 ALDH1A1 (0.40) KMT2AABL1RIN1TDP1GAA
SCHEMBL7897381 0.75 F2 (0.56) KMT2AGAAF2F10PRSS1
SCHEMBL7897384 0.75 F2 (0.56) KMT2AGAAF2F10PRSS1
SCHEMBL4760675 0.74 F2 (0.48) KMT2AGAAF2F10PRSS1

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