SCHEMBL28049776

SCHEMBL28049776

O=C(O)C1=C(Nc2ccccc2Cl)CC(C(=O)O)=C(Nc2ccccc2Cl)C1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CXCL8 P10145 1/20 0.49
▸ MEN1 O00255 4/20 0.45
▸ KMT2A Q03164 4/20 0.45
▸ NPC1 O15118 4/20 0.44
▸ RAB9A P51151 4/20 0.44
▸ MAPT P10636 2/20 0.44
▸ POLB P06746 2/20 0.44
▸ KDM4E B2RXH2 1/20 0.44
▸ GAA P10253 1/20 0.44
▸ MAPK1 P28482 1/20 0.44
▸ NPSR1 Q6W5P4 1/20 0.44
▸ TDP1 Q9NUW8 1/20 0.44
▸ PBRM1 Q86U86 1/20 0.44
▸ LMNA P02545 2/20 0.43
▸ SMN1; SMN2 Q16637 2/20 0.43
▸ CYP2C19 P33261 3/20 0.43
▸ CYP1A2 P05177 2/20 0.43
▸ HPGD P15428 2/20 0.43
▸ USP2 O75604 1/20 0.43
▸ MT-CO2 P00403 1/20 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
SCHEMBL1415624 0.76 CASP3 (0.45) MEN1KMT2AMAPTPOLBKDM4E
SCHEMBL28049775 0.73 KMT2A (0.43) CXCL8MEN1KMT2ANPC1RAB9A
SCHEMBL4249088 0.73 PBRM1 (0.75) CXCL8MEN1KMT2AMAPTMAPK1
SCHEMBL30575470 0.73 PBRM1 (0.75) CXCL8MEN1KMT2AMAPTMAPK1
SCHEMBL28297347 0.71 PBRM1 (0.73) CXCL8MEN1KMT2AMAPTMAPK1
SCHEMBL11580885 0.71 FTO (0.55) CXCL8MEN1KMT2AMAPTMAPK1
SCHEMBL1415827 0.71 AKR1C3 (0.45) MEN1KMT2ANPC1RAB9AMAPT
SCHEMBL6558595 0.71 PBRM1 (0.58) CXCL8MEN1KMT2AMAPTPBRM1
SCHEMBL30832916 0.71 PBRM1 (0.58) CXCL8MEN1KMT2AMAPTPBRM1
SCHEMBL28049711 0.70 MEN1 (0.54) MEN1KMT2ANPC1RAB9AMAPT

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-105189659-A Quinacridone pigment of low amine content and method for producing same DAINIPPON INK & CHEMICALS 2015-12-23 — — CN disclosed
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