SCHEMBL7434341

SCHEMBL7434341

COc1ccc2c(c1)NC(=O)C(Cl)(Cl)CC2

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
OTUD7B Q6GQQ9 1/20 0.49
SRC P12931 1/20 0.46
HTR5A P47898 2/20 0.44
PDE7A Q13946 2/20 0.44
PDE3B Q13370 2/20 0.42
PDE3A Q14432 2/20 0.42
ALDH1A1 P00352 1/20 0.41
CYP3A4 P08684 1/20 0.41
THRB P10828 1/20 0.41
MAPK1 P28482 1/20 0.41
EIF2AK2 P19525 1/20 0.40
ADRA2A P08913 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
AKR1B1 P15121 1/20 0.39
MAOB P27338 2/20 0.39
MAOA P21397 1/20 0.39

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
SCHEMBL6000781 0.84 OTUD7B (0.50) OTUD7BSRCHTR5APDE7APDE3B
SCHEMBL7430923 0.78 ALDH1A1 (0.49) OTUD7BSRCHTR5APDE7APDE3B
SCHEMBL703728 0.76 MAOB (0.58) PDE3BPDE3AEIF2AK2MAOBMAOA
SCHEMBL29724095 0.76 MAOB (0.58) PDE3BPDE3AEIF2AK2MAOBMAOA
SCHEMBL1513178 0.74 MAPT (0.53) HTR5APDE7APDE3BPDE3AEIF2AK2
SCHEMBL16896923 0.74 OTUD7B (0.55) OTUD7BSRCHTR5APDE7APDE3B
SCHEMBL8880893 0.73 OTUD7B (0.48) OTUD7BPDE7AALDH1A1SMN1; SMN2MAOB
SCHEMBL5999174 0.73 PDE3B (0.59) OTUD7BSRCHTR5APDE7APDE3B
SCHEMBL7426931 0.73 NPC1 (0.53) OTUD7BSRCALDH1A1THRBMAPK1
SCHEMBL9405637 0.72 DRD2 (0.49) OTUD7BSRCHTR5APDE3BPDE3A

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