SCHEMBL11227486

SCHEMBL11227486

Clc1nc2c[c]ccc2nc1Cl

nearest known ligand 0.50

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.50
KDM4E B2RXH2 1/20 0.34
PKM P14618 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.31

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
SCHEMBL28338278 0.80 KDM4E (0.68) TDP1KDM4EPKML3MBTL1
SCHEMBL23844 0.78 MAPT (0.55) TDP1KDM4EL3MBTL1
SCHEMBL6714495 0.76
SCHEMBL194246 0.76 MAPT (0.39) TDP1KDM4E
SCHEMBL19924588 0.74 ALDH1A1 (0.42)
SCHEMBL18526971 0.74 ALDH1A1 (0.42)
SCHEMBL27531134 0.73 MEN1 (0.42) TDP1KDM4EPKML3MBTL1
SCHEMBL15516686 0.71 CYP1A2 (0.35) TDP1KDM4E
SCHEMBL193961 0.71 KMT2A (0.34) KDM4EL3MBTL1
SCHEMBL15987437 0.70 KDM4E (0.50) TDP1KDM4EPKML3MBTL1

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-4303652-A Fiber-reactive phosphorus mothproofing agents COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANIZATION (AU) 1981-12-01 US claimed
CN-106573000-B Arylamine substituted quinoxalines as anti-cancer agents 陈昆锋 2020-02-07 CN disclosed
CN-106573000-A Arylamine substituted quinoxalines as anti-cancer agents 陈昆锋 2017-04-19 CN disclosed
US-4343618-A Mothproofing agents COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANIZATION (AU) 1982-08-10 US disclosed
US-4303652-A Fiber-reactive phosphorus mothproofing agents COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANIZATION (AU) 1981-12-01 US disclosed