SCHEMBL8438002

SCHEMBL8438002

O=[N+]([O-])c1ccccc1C1(N=Nc2ccccc2O)C=C(CCO)C=CC1O

nearest known ligand 0.30

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PTPN11 Q06124 1/20 0.30
PLAU P00749 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
SCHEMBL8435057 0.94 KDM4E (0.31)
SCHEMBL8434817 0.94 KDM4E (0.31)
SCHEMBL8440442 0.89 MEN1 (0.36)
SCHEMBL8440144 0.79 PLAU (0.35) PTPN11PLAU
SCHEMBL24213305 0.64 NPC1 (0.59) PTPN11PLAU
SCHEMBL5838349 0.64 NPC1 (0.59) PTPN11PLAU
SCHEMBL5838346 0.64 NPC1 (0.59) PTPN11PLAU
Nitrophenolate SCHEMBL27457258 0.64 NPC1 (0.59) PTPN11PLAU
SCHEMBL28233562 0.63 MEN1 (0.33)
SCHEMBL28666168 0.62 MEN1 (0.38)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5922882-A ULTRAVIOLET RADIATION ABSORBER; COPOLYMERIZATION COMPONENT OF BISBENZOTRIAZOLE COMPRISING A COPOLYCARBONATE, A COPOLYESTER, A COPOLYURETHANE AND A COPOLYURETHANEURA OTSUKA KAGAKU KABUSHIKI KAISHA (JP) 1999-07-13 US disclosed