SCHEMBL3435004

SCHEMBL3435004

CCOC(=O)C1=C(CBr)Nc2c(c(=O)[nH]c(=O)n2-c2ccccc2)C1c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 2/20 0.48
BRDT Q58F21 2/20 0.48
BRD2 P25440 1/20 0.48
BRD3 Q15059 1/20 0.48
MAT2A P31153 1/20 0.46
KDM4E B2RXH2 5/20 0.45
HTT P42858 2/20 0.45
ADORA3 P0DMS8 1/20 0.43
GAA P10253 3/20 0.42
ALDH1A1 P00352 4/20 0.40
MAPT P10636 2/20 0.40
TDP1 Q9NUW8 1/20 0.39
SIRT3 Q9NTG7 1/20 0.39
NPC1 O15118 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
ACHE P22303 1/20 0.37
POLB P06746 1/20 0.37
CACNA1D Q01668 1/20 0.37
MEN1 O00255 1/20 0.37
HPGD P15428 1/20 0.37

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
SCHEMBL13012488 0.90 BRD4 (0.48) BRD4BRDTBRD2BRD3MAT2A
SCHEMBL3431831 0.89 BRD4 (0.47) BRD4BRDTBRD2BRD3MAT2A
SCHEMBL2725332 0.88 BRD4 (0.60) BRD4BRDTBRD2BRD3MAT2A
SCHEMBL13014401 0.80 BRD4 (0.41) BRD4BRDTBRD2BRD3MAT2A
SCHEMBL3433034 0.77 BRD4 (0.48) BRD4BRDTBRD2BRD3MAT2A
SCHEMBL9976375 0.76 BRD4 (0.48) BRD4BRDTBRD2BRD3MAT2A
SCHEMBL13012731 0.76 BRD4 (0.38) BRD4BRDTBRD2BRD3MAT2A
SCHEMBL3434014 0.73 BRD4 (0.45) BRD4BRDTBRD2BRD3MAT2A
SCHEMBL3435001 0.72 ALDH1A1 (0.41) KDM4EHTTADORA3GAAALDH1A1
SCHEMBL13012739 0.71 BRD4 (0.46) BRD4BRDTBRD2BRD3MAT2A

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
WO-2010149786-A1 PYRIDO [2, 3-D] PYRIMIDINES AS WNT ANTAGONISTS FOR TREATMENT OF CANCER AND ARTHRITIS DEUTSCHES KREBSFORSCHUNGSZENTRUM (DE) 2010-12-29 WO disclosed
WO-2010149786-A1 PYRIDO [2, 3-D] PYRIMIDINES AS WNT ANTAGONISTS FOR TREATMENT OF CANCER AND ARTHRITIS DEUTSCHES KREBSFORSCHUNGSZENTRUM (DE) 2010-12-29 WO disclosed
EP-2266984-A1 Pyrido[2,3-d]pyrimidines as Wnt antagonists for treatment of cancer and arthritis Deutsches Krebsforschungszentrum Stiftung des öffentlichen Rechts (DE) 2010-12-29 EP disclosed
EP-2266984-A1 Pyrido[2,3-d]pyrimidines as Wnt antagonists for treatment of cancer and arthritis Deutsches Krebsforschungszentrum Stiftung des öffentlichen Rechts (DE) 2010-12-29 EP disclosed