SCHEMBL9870753

SCHEMBL9870753

CCCCOC(=O)CCc1cc(-n2nc3ccc(Cl)cc3n2)c(O)c(C(C)(C)C)c1

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 1/20 0.40
EPHX2 P34913 5/20 0.38
ALDH1A1 P00352 3/20 0.37
TDP1 Q9NUW8 2/20 0.37
L3MBTL1 Q9Y468 2/20 0.37
GAA P10253 2/20 0.36
KMT2A Q03164 1/20 0.36
KDM4E B2RXH2 1/20 0.34
MAOA P21397 1/20 0.33
MAOB P27338 1/20 0.33
ALOX15 P16050 1/20 0.33

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
SCHEMBL13030430 0.96 EPHX2 (0.41) CNR1EPHX2ALDH1A1TDP1L3MBTL1
SCHEMBL78014 0.96 EPHX2 (0.41) CNR1EPHX2ALDH1A1TDP1L3MBTL1
SCHEMBL29403911 0.96 EPHX2 (0.41) CNR1EPHX2ALDH1A1TDP1L3MBTL1
SCHEMBL9229451 0.96 EPHX2 (0.41) CNR1EPHX2ALDH1A1TDP1L3MBTL1
SCHEMBL7525719 0.95 GAA (0.38) CNR1EPHX2GAAKMT2AMAOA
SCHEMBL9615371 0.93 GAA (0.34) CNR1EPHX2GAAKMT2AMAOA
SCHEMBL28786801 0.93 EPHX2 (0.42) CNR1EPHX2GAAKMT2AMAOA
SCHEMBL22915501 0.93 EPHX2 (0.38) CNR1EPHX2
SCHEMBL3288191 0.91 ALOX5 (0.36) ALDH1A1GAAKMT2AKDM4EMAOA
SCHEMBL31147816 0.91 GAA (0.39) GAAKMT2AKDM4EMAOAMAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5032498-A Soluble stabilizers CIBA-GEIGY CORPORATION (US) 1991-07-16 US disclosed
US-4973702-A AMIDES AND ESTERS, UV STABILIZERS FOR PLASTICS AND PHOTOGRAPHIC MATERIALS CIBA-GEIGY CORPORATION (US) 1990-11-27 US disclosed
US-4853471-A 2-(2-Hydroxyphenyl)-benztriazoles, their use as UV-absorbers and their preparation CIBA-GEIGY CORPORATION (US) 1989-08-01 US disclosed
EP-0057160-B1 2-(2-HYDROXYPHENYL)-BENZOTRIAZOLES, THEIR USE AS ULTRAVIOLET STABILIZERS AND THEIR PREPARATION CIBA-GEIGY AG (CH) 1985-06-19 EP disclosed
EP-0057160-A1 2-(2-Hydroxyphenyl)-benzotriazoles, their use as ultraviolet stabilizers and their preparation CIBA-GEIGY AG (CH) 1982-08-04 EP disclosed