SCHEMBL28045984

SCHEMBL28045984

COc1cccc(OC)c1NC(=O)CC(C)=O

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.53
KMT2A Q03164 4/20 0.53
ALDH1A1 P00352 4/20 0.53
PKM P14618 1/20 0.46
MAPT P10636 1/20 0.45
LMNA P02545 1/20 0.44
HTT P42858 1/20 0.44
USP2 O75604 1/20 0.44
TSHR P16473 1/20 0.44
CA12 O43570 1/20 0.44
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
CA7 P43166 1/20 0.44
CA9 Q16790 1/20 0.44
CA14 Q9ULX7 1/20 0.44
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
POLB P06746 1/20 0.43
KDM4E B2RXH2 1/20 0.42
CYP1A2 P05177 1/20 0.42

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
SCHEMBL17886503 0.82 MEN1 (0.46) MEN1KMT2AALDH1A1PKMUSP2
SCHEMBL11318304 0.82 SMN1; SMN2 (0.56) MEN1KMT2AALDH1A1PKMMAPT
SCHEMBL28045985 0.81 MEN1 (0.60) MEN1KMT2AALDH1A1PKMMAPT
SCHEMBL7500143 0.81 KDM4E (0.53) MEN1KMT2AALDH1A1MAPTLMNA
SCHEMBL54737 0.81 KMT2A (0.69) MEN1KMT2AALDH1A1MAPTLMNA
SCHEMBL31590799 0.81 KMT2A (0.69) MEN1KMT2AALDH1A1MAPTLMNA
SCHEMBL28046011 0.80 ALDH1A1 (0.55) MEN1KMT2AALDH1A1MAPTLMNA
SCHEMBL11705582 0.80 MEN1 (0.58) MEN1KMT2AALDH1A1PKMMAPT
SCHEMBL18415530 0.79 CA12 (0.52) ALDH1A1MAPTLMNACA12CA1
SCHEMBL20514124 0.78 PKM (0.59) MEN1KMT2APKMTSHRCA12

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
CN-105143353-A Disazo pigment composition and method for producing same TOYO INK SC HOLDINGS CO LTD 2015-12-09 CN disclosed