SCHEMBL14408368

SCHEMBL14408368

O=c1oc2c3c4c(cc2cc1-c1ncccc1Br)CCCN4CCC3

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ USP2 O75604 7/20 0.58
▸ CASP1 P29466 5/20 0.58
▸ CASP7 P55210 5/20 0.58
▸ BRCA1 P38398 2/20 0.58
▸ HBB P68871 2/20 0.58
▸ TP53 P04637 1/20 0.58
▸ SLC16A3 O15427 1/20 0.53
▸ ALDH1A1 P00352 8/20 0.52
▸ MEN1 O00255 8/20 0.52
▸ KMT2A Q03164 8/20 0.52
▸ MAPT P10636 6/20 0.52
▸ GAA P10253 5/20 0.52
▸ KDM4E B2RXH2 5/20 0.52
▸ LMNA P02545 4/20 0.52
▸ TDP1 Q9NUW8 3/20 0.52
▸ RECQL P46063 3/20 0.52
▸ TLR9 Q9NR96 1/20 0.52
▸ ALOX15 P16050 4/20 0.43
▸ HSD17B10 Q99714 4/20 0.43
▸ HTT P42858 2/20 0.43

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
SCHEMBL13432142 0.82 USP2 (0.63) USP2CASP1CASP7BRCA1HBB
SCHEMBL30378821 0.80 USP2 (0.60) USP2CASP1CASP7BRCA1HBB
SCHEMBL13432094 0.80 USP2 (0.60) USP2CASP1CASP7BRCA1HBB
SCHEMBL13486876 0.79 SLC16A3 (0.69) USP2CASP1CASP7BRCA1HBB
SCHEMBL4309506 0.79 USP2 (0.61) USP2CASP1CASP7BRCA1HBB
SCHEMBL15398194 0.79 USP2 (0.66) USP2CASP1CASP7BRCA1HBB
SCHEMBL14408384 0.78 SLC16A3 (0.52) USP2CASP1CASP7BRCA1HBB
SCHEMBL15398217 0.77 USP2 (0.64) USP2CASP1CASP7BRCA1HBB
SCHEMBL24176812 0.75 USP2 (0.59) USP2CASP1CASP7BRCA1HBB
SCHEMBL29786959 0.75 USP2 (0.67) USP2CASP1CASP7BRCA1HBB

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-7270938-B2 Photopolymerizable composition, light sensitive planographic printing plate material and manufacturing method of planographic printing plate KONICA MINOLTA MEDICAL & GRAPHIC, INC. (JP) 2007-09-18 — — US disclosed
US-7270938-B2 Photopolymerizable composition, light sensitive planographic printing plate material and manufacturing method of planographic printing plate KONICA MINOLTA MEDICAL & GRAPHIC, INC. (JP) 2007-09-18 — — US disclosed
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