SCHEMBL11704331

SCHEMBL11704331

CCN1C(=O)c2cc(Br)c(N)c(Br)c2C1=O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1B1 Q16678 5/20 0.44
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
ATM Q13315 2/20 0.38
USP2 O75604 1/20 0.38
KEAP1 Q14145 1/20 0.38
NFE2L2 Q16236 1/20 0.38
POLB P06746 3/20 0.36
CLTC Q00610 1/20 0.36
ALDH1A1 P00352 5/20 0.33
MAPT P10636 4/20 0.33
KDM4E B2RXH2 3/20 0.33
SMN1; SMN2 Q16637 3/20 0.33
NPSR1 Q6W5P4 2/20 0.33
APAF1 O14727 1/20 0.33
GAA P10253 1/20 0.33
THRB P10828 1/20 0.33
TSHR P16473 1/20 0.33
LMNA P02545 2/20 0.32
MAPK1 P28482 2/20 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
SCHEMBL3684269 0.85 CYP1B1 (0.48) CYP1B1MEN1KMT2AATMUSP2
SCHEMBL9400293 0.78 CYP1B1 (0.41) CYP1B1MEN1KMT2AATMUSP2
SCHEMBL9400286 0.78 ALDH1A1 (0.36) MEN1KMT2AATMUSP2KEAP1
SCHEMBL9156396 0.76 CYP1B1 (0.45) CYP1B1MEN1KMT2AATMUSP2
SCHEMBL127891 0.76 CYP1B1 (0.56) CYP1B1MEN1KMT2AATMUSP2
SCHEMBL10658959 0.75 CYP1B1 (0.53) CYP1B1MEN1KMT2AATMUSP2
SCHEMBL128105 0.75 CYP1B1 (0.55) CYP1B1MEN1KMT2AATMUSP2
SCHEMBL13743265 0.74 ALDH1A1 (0.46) MEN1KMT2AALDH1A1MAPTSMN1; SMN2
SCHEMBL19239495 0.70 CYP1B1 (0.51) CYP1B1MEN1KMT2AATMUSP2
SCHEMBL12711546 0.70 CYP1B1 (0.46) CYP1B1MEN1KMT2AATMUSP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4012372-A MONOAZO DISPERSE DYES EASTMAN KODAK COMPANY (US) 1977-03-15 US disclosed
US-3980634-A Phthalimidyl-azo aniline type compounds and polyester fibers dyed therewith EASTMAN KODAK COMPANY (US) 1976-09-14 US disclosed