SCHEMBL11242963

SCHEMBL11242963

CCCCCCCCNc1ccc(C(=O)O)cc1[N+](=O)[O-]

nearest known ligand 0.97

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HCAR3 P49019 11/20 0.97
PRSS1 P07477 4/20 0.63
MAPT P10636 4/20 0.62
GAA P10253 1/20 0.62
NPC1 O15118 1/20 0.59
ALDH1A1 P00352 1/20 0.59
PKM P14618 1/20 0.59
CRHBP P24387 1/20 0.59
RAB9A P51151 1/20 0.59
CRHR2 Q13324 1/20 0.59

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
SCHEMBL6044600 1.00 HCAR3 (0.97) HCAR3PRSS1MAPTGAANPC1
SCHEMBL11208444 1.00 HCAR3 (0.97) HCAR3PRSS1MAPTGAANPC1
SCHEMBL6044024 0.99 HCAR3 (1.00) HCAR3PRSS1MAPTGAANPC1
SCHEMBL6044176 0.95 HCAR3 (1.00) HCAR3PRSS1MAPTGAANPC1
SCHEMBL2688335 0.89 HCAR3 (1.00) HCAR3MAPTNPC1ALDH1A1PKM
SCHEMBL9192588 0.86 HCAR3 (0.77) HCAR3PRSS1MAPTNPC1ALDH1A1
SCHEMBL15321333 0.85 MAPT (0.82) HCAR3PRSS1MAPTNPC1ALDH1A1
SCHEMBL10524428 0.85 HCAR3 (0.76) HCAR3PRSS1MAPTGAANPC1
SCHEMBL3278681 0.85 HCAR3 (0.78) HCAR3PRSS1MAPTALDH1A1
SCHEMBL9247817 0.85 HCAR3 (0.71) HCAR3PRSS1MAPTGAANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4347180-A High caustic coupling process for preparing substituted 2-nitro-2'-hydroxyazobenzenes CIBA-GEIGY CORPORATION (US) 1982-08-31 US disclosed
US-4275004-A High caustic coupling process for preparing substituted 2-nitro-2'-hydroxyazobenzenes CIBA-GEIGY CORPORATION (US) 1981-06-23 US disclosed
US-4230867-A REDUCTION, CYCLIZATION OF NITROAZOBENZENES CIBA-GEIGY CORPORATION (US) 1980-10-28 US disclosed
US-4219480-A REDUCTION OF UNDESIRED BY-PRODUCT AND EFFLUENT POLLUTION PROBLEMS CIBA-GEIGY CORPORATION (US) 1980-08-26 US disclosed
US-4141903-A REDUCTION AND CYCLIZATION OF THE CORRESPONDING O-NITROAZOBENZENES WITH CARBON MONOXIDE USING A COPPER-AMINE COMPLEX AS CATALYST CIBA-GEIGY CORPORATION (US) 1979-02-27 US disclosed
US-4041044-A BY REDUCTION OF CORRESPONDING O-NITRO-AZOBENZENES WITH ZINC IN AQUEOUS ALKALI METAL HYDROXIDE CIBA-GEIGY CORPORATION (US) 1977-08-09 US disclosed