SCHEMBL7704422

SCHEMBL7704422

c1coc(Cc2ncco2)n1

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CYP1B1 Q16678 1/20 0.32
EDNRB P24530 1/20 0.30
EDNRA P25101 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
SCHEMBL28136399 0.83
SCHEMBL29086344 0.82 CYP1B1 (0.32) CYP1B1
SCHEMBL25391446 0.79
SCHEMBL6165634 0.79 S1PR1 (0.41) EDNRBEDNRA
SCHEMBL916382 0.78
SCHEMBL1680482 0.78
SCHEMBL1680347 0.78
SCHEMBL16011600 0.78
SCHEMBL1259823 0.78
SCHEMBL289071 0.78

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
EP-3048156-A1 ORGANIC MOLECULES, IN PARTICULAR FOR USE IN OPTOELECTRONIC COMPONENTS cynora GmbH (DE) 2016-07-27 EP disclosed
EP-3048155-A1 ORGANIC MOLECULES, IN PARTICULAR FOR USE IN OPTOELECTRONIC COMPONENTS cynora GmbH (DE) 2016-07-27 EP disclosed
US-20140288215-A1 HYDROLYSIS RESISTANT AND BIODEGRADABLE ALIPHATIC-AROMATIC COPOLYESTER RESIN COMPOSITION Gio-Soltech Co., Ltd. (KR) 2014-09-25 US disclosed
US-6362337-B1 ACYLATING A HYDROXYPHENYLURACIL COMPOUND BAYER AKTIENGESELLSCHAFT (DE) 2002-03-26 US disclosed
US-3985763-A DYESTUFFS BAYER AKTIENGESELLSCHAFT (DT) 1976-10-12 US disclosed