SCHEMBL11537145

SCHEMBL11537145

O=C(CC(NO)c1cccc(Cl)c1)NO

nearest known ligand 0.70

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
ALDH1A1 P00352 1/20 0.45
HPGD P15428 1/20 0.45

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
SCHEMBL28520767 0.83 ADRB2 (0.50)
SCHEMBL13851783 0.72 CTSA (0.51) MEN1KMT2AALDH1A1HPGD
SCHEMBL18162818 0.72 ALDH1A1 (0.51) MEN1KMT2AALDH1A1
SCHEMBL4596498 0.71 MAPK1 (0.51) MEN1KMT2A
SCHEMBL3446408 0.71 MAPK1 (0.51) MEN1KMT2A
SCHEMBL29751787 0.71 MAPK1 (0.46) MEN1KMT2AALDH1A1HPGD
SCHEMBL16901655 0.71 MAPK1 (0.46) MEN1KMT2AALDH1A1HPGD
SCHEMBL31037006 0.71 MAPK1 (0.46) MEN1KMT2AALDH1A1HPGD
SCHEMBL14107607 0.71 IDO1 (0.46) MEN1KMT2A
SCHEMBL14393701 0.70 MAPK1 (0.47) MEN1KMT2A

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4156739-A B-HYDROXYAMINO-HYDROCINNAMONYLHYDROXAMIC ACIDS RESEARCH CORPORATION (US) 1979-05-29 US disclosed
US-4098903-A ANTI-HYPERTENSIVE COMPOUNDS RESEARCH CORPORATION (US) 1978-07-04 US disclosed
US-4083864-A ANTIHYPERTENSIVE AGENTS RESEARCH CORPORATION (US) 1978-04-11 US disclosed