SCHEMBL11291846

SCHEMBL11291846

Nc1c(Br)cc(NC(=O)c2ccccc2Oc2ccccc2)c2c1C(=O)c1ccccc1C2=O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 1/20 0.50
▸ MEN1 O00255 4/20 0.48
▸ KMT2A Q03164 4/20 0.48
▸ RXFP1 Q9HBX9 2/20 0.46
▸ POLB P06746 1/20 0.46
▸ CCR6 P51684 1/20 0.46
▸ BLM P54132 1/20 0.46
▸ TDP1 Q9NUW8 1/20 0.45
▸ L3MBTL1 Q9Y468 1/20 0.45
▸ ADORA2A P29274 1/20 0.44
▸ CYP1A2 P05177 1/20 0.44
▸ GAA P10253 1/20 0.43
▸ TSHR P16473 1/20 0.43
▸ P2RY12 Q9H244 1/20 0.43
▸ P2RY2 P41231 1/20 0.42
▸ P2RY6 Q15077 1/20 0.42
▸ ALDH1A1 P00352 1/20 0.42
▸ MAPK1 P28482 1/20 0.42
▸ HSD17B10 Q99714 1/20 0.42
▸ MMP14 P50281 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
SCHEMBL11289736 0.87 RAB9A (0.50) RAB9AMEN1KMT2ARXFP1POLB
SCHEMBL11292275 0.87 CASP3 (0.54) RAB9AMEN1KMT2AGAATSHR
SCHEMBL11298454 0.85 MEN1 (0.55) MEN1KMT2ARXFP1POLBCCR6
SCHEMBL11291969 0.81 PTPRC (0.51) RAB9AMEN1KMT2ARXFP1POLB
SCHEMBL11293834 0.81 CASP3 (0.50) RAB9AMEN1KMT2ARXFP1POLB
SCHEMBL11290029 0.81 MEN1 (0.67) MEN1KMT2ARXFP1POLBCCR6
SCHEMBL11291830 0.77 ALDH1A1 (0.46) RAB9AMEN1KMT2ARXFP1POLB
SCHEMBL11300437 0.77 MEN1 (0.58) MEN1KMT2ARXFP1POLBCCR6
SCHEMBL11298206 0.76 MEN1 (0.58) MEN1KMT2ARXFP1POLBCCR6
SCHEMBL11295480 0.76 HDAC1 (0.54) RAB9AMEN1KMT2ARXFP1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0006574-B1 PROCESS FOR THE BULK DYEING OF LINEAR POLYESTERS WITH ANTHRAQUINONE DYESTUFFS CIBA-GEIGY AG (CH) 1982-03-24 — — EP disclosed
US-4276213-A Process for the coloration of organic material of high molecular weight in the melt with anthraquinone dyes CIBA-GEIGY CORPORATION (US) 1981-06-30 — — US disclosed
EP-0006574-A1 Process for the bulk dyeing of linear polyesters with anthraquinone dyestuffs CIBA-GEIGY AG (CH) 1980-01-09 — — EP disclosed
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