SCHEMBL7760977

SCHEMBL7760977

O=[N+]([O-])C1(O)C=CC=CC1N=Nc1ccccc1

nearest known ligand 0.34

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.34
LMNA P02545 1/20 0.34
GAA P10253 1/20 0.34
POLB P06746 1/20 0.31
CYP2D6 P10635 1/20 0.31
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
CYP2C19 P33261 1/20 0.31
NPC1 O15118 1/20 0.30
RAB9A P51151 1/20 0.30

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
SCHEMBL7760972 1.00 ALDH1A1 (0.34) ALDH1A1LMNAGAAPOLBCYP2D6
SCHEMBL7086931 0.77 ALDH1A1 (0.33) ALDH1A1LMNAGAAMEN1KMT2A
SCHEMBL7086930 0.77 ALDH1A1 (0.33) ALDH1A1LMNAGAAMEN1KMT2A
SCHEMBL3746371 0.77 ALDH1A1 (0.37) ALDH1A1POLBCYP2D6MEN1KMT2A
SCHEMBL3746366 0.77 ALDH1A1 (0.37) ALDH1A1POLBCYP2D6MEN1KMT2A
SCHEMBL8653462 0.72 ALDH1A1 (0.38) ALDH1A1MEN1KMT2ANPC1RAB9A
SCHEMBL8653465 0.72 ALDH1A1 (0.38) ALDH1A1MEN1KMT2ANPC1RAB9A
SCHEMBL31212777 0.71 ALDH1A1 (0.37) ALDH1A1MEN1KMT2ANPC1RAB9A
SCHEMBL28844308 0.71 ALDH1A1 (0.37) ALDH1A1MEN1KMT2ANPC1RAB9A
SCHEMBL7085063 0.70

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
CN-102174000-B Synthetic method of benzotriazole ultraviolet absorbent azo intermediate UNIV ZHEJIANG TECHNOLOGY 2014-08-06 CN disclosed
CN-102174000-A Synthetic method of benzotriazole ultraviolet absorbent azo intermediate UNIV ZHEJIANG TECHNOLOGY 2011-09-07 CN disclosed
CN-102060794-A Method for refining crude benzotriazole ultraviolet absorber RIONLON TIANJIN CHEMICAL CO LTD 2011-05-18 CN disclosed
JP-2001031658-A PRODUCTION OF BENZOTRIAZOLE-BASED COMPOUND OSAKA SEIKA KOGYO KK 2001-02-06 JP disclosed