SCHEMBL11299151

SCHEMBL11299151

Nc1c(Br)cc(NC(=O)c2cccc(Cl)c2)c2c1C(=O)c1ccccc1C2=O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.54
KMT2A Q03164 4/20 0.54
RXFP1 Q9HBX9 2/20 0.54
POLB P06746 1/20 0.54
CCR6 P51684 1/20 0.54
BLM P54132 1/20 0.54
MMP14 P50281 1/20 0.50
KCNMA1 Q12791 1/20 0.47
HSP90AA1 P07900 2/20 0.46
HSP90AB1 P08238 2/20 0.46
NPC1 O15118 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
KCNK3 O14649 1/20 0.45
KCNK9 Q9NPC2 1/20 0.45
MAPT P10636 5/20 0.44
P2RY2 P41231 1/20 0.44
P2RY4 P51582 1/20 0.44
P2RY12 Q9H244 1/20 0.44
GPR35 Q9HC97 1/20 0.43
CYP1A2 P05177 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
SCHEMBL11290065 0.92 MEN1 (0.54) MEN1KMT2ARXFP1POLBCCR6
SCHEMBL11299034 0.88 MEN1 (0.56) MEN1KMT2ARXFP1POLBCCR6
SCHEMBL11296310 0.88 MEN1 (0.56) MEN1KMT2ARXFP1POLBCCR6
SCHEMBL11290029 0.88 MEN1 (0.67) MEN1KMT2ARXFP1POLBCCR6
SCHEMBL6424210 0.84 MEN1 (0.60) MEN1KMT2ARXFP1POLBMMP14
SCHEMBL11291830 0.84 ALDH1A1 (0.46) MEN1KMT2ARXFP1POLBCCR6
SCHEMBL11347499 0.84 KMT2A (0.47) MEN1KMT2ARXFP1POLBCCR6
SCHEMBL11296414 0.84 KMT2A (0.48) MEN1KMT2ARXFP1POLBCCR6
SCHEMBL11298206 0.83 MEN1 (0.58) MEN1KMT2ARXFP1POLBCCR6
SCHEMBL11291214 0.83 ALDH1A1 (0.47) MEN1KMT2ARXFP1POLBCCR6

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