SCHEMBL2175137

SCHEMBL2175137

CCN(C)c1cc(Nc2ccc(OC)cc2)ncn1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.66
KMT2A Q03164 4/20 0.66
RAB9A P51151 3/20 0.59
NPC1 O15118 2/20 0.59
CDK4 P11802 3/20 0.55
LCK P06239 3/20 0.50
EGFR P00533 3/20 0.48
ERBB3 P21860 3/20 0.48
ALDH1A1 P00352 1/20 0.46
GAA P10253 1/20 0.46
MAPT P10636 1/20 0.46
HTT P42858 1/20 0.46
TNNI3K Q59H18 1/20 0.46
GALR2 O43603 1/20 0.45
ABL1 P00519 1/20 0.45
BCR P11274 1/20 0.45
GABRG2 P18507 1/20 0.44
GABRB3 P28472 1/20 0.44
GABRA5 P31644 1/20 0.44
FGFR3 P22607 1/20 0.44

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
SCHEMBL12481659 0.86 MEN1 (0.61) MEN1KMT2ARAB9ANPC1CDK4
SCHEMBL12486513 0.77 MEN1 (0.79) MEN1KMT2ARAB9ANPC1CDK4
SCHEMBL12485614 0.75 MEN1 (0.87) MEN1KMT2ARAB9ANPC1CDK4
SCHEMBL10187337 0.75 MEN1 (0.81) MEN1KMT2ARAB9ANPC1CDK4
SCHEMBL12487662 0.75 MEN1 (0.74) MEN1KMT2ARAB9ANPC1CDK4
SCHEMBL1097149 0.74 MEN1 (0.78) MEN1KMT2ARAB9ANPC1CDK4
SCHEMBL856014 0.74 MEN1 (0.78) MEN1KMT2ARAB9ANPC1CDK4
SCHEMBL12484521 0.73 MEN1 (0.70) MEN1KMT2ARAB9ANPC1CDK4
SCHEMBL12485502 0.73 MEN1 (0.70) MEN1KMT2ARAB9ANPC1CDK4
SCHEMBL374352 0.73 LCK (0.66) MEN1KMT2ARAB9ANPC1LCK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2519501-A2 SUBSTITUTED PYRIDINES AND PYRIMIDINES FOR THE PRODUCTION OF CARDIOMYOCYTE-LIKE CELLS Technische Universität Wien (AT) 2012-11-07 EP claimed
WO-2011079343-A2 SUBSTITUTED PYRIDINES AND PYRIMIDINES TECHNISCHE UNIVERSITAET WIEN (AT) 2011-07-07 WO claimed
EP-2519501-A2 SUBSTITUTED PYRIDINES AND PYRIMIDINES FOR THE PRODUCTION OF CARDIOMYOCYTE-LIKE CELLS Technische Universität Wien (AT) 2012-11-07 EP disclosed
WO-2011079343-A2 SUBSTITUTED PYRIDINES AND PYRIMIDINES TECHNISCHE UNIVERSITAET WIEN (AT) 2011-07-07 WO disclosed