SCHEMBL3433377

SCHEMBL3433377

CC1=CC(c2ccccc2)c2c(n(-c3ccccc3)c(=O)[nH]c2=O)N1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAT2A P31153 2/20 0.39
MAPK1 P28482 1/20 0.38
TP53 P04637 1/20 0.36
ALDH1A1 P00352 5/20 0.36
KDM4E B2RXH2 3/20 0.36
HPGD P15428 2/20 0.36
GAA P10253 5/20 0.36
THRB P10828 1/20 0.35
LIPG Q9Y5X9 1/20 0.35
BRD4 O60885 1/20 0.35
BRDT Q58F21 1/20 0.35
GSK3A P49840 1/20 0.35
GSK3B P49841 1/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
MAPT P10636 2/20 0.34
TDP1 Q9NUW8 2/20 0.34
HSD17B10 Q99714 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
TSHR P16473 1/20 0.34

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
SCHEMBL13012735 0.81 HPGD (0.37) MAT2AMAPK1TP53ALDH1A1KDM4E
SCHEMBL13012888 0.77 MAT2A (0.38) MAT2AALDH1A1KDM4EHPGDGAA
SCHEMBL3433034 0.74 BRD4 (0.48) MAT2AMAPK1ALDH1A1KDM4EHPGD
SCHEMBL9976375 0.73 BRD4 (0.48) MAT2AMAPK1ALDH1A1KDM4EGAA
SCHEMBL3434768 0.73 BRD4 (0.39) MAT2AMAPK1TP53ALDH1A1KDM4E
SCHEMBL3434014 0.72 BRD4 (0.45) MAT2AMAPK1TP53ALDH1A1KDM4E
SCHEMBL13012896 0.71 BRD4 (0.39) MAT2AMAPK1TP53ALDH1A1KDM4E
SCHEMBL3432096 0.71 BRD4 (0.39) MAT2AMAPK1TP53ALDH1A1KDM4E
SCHEMBL2725332 0.69 BRD4 (0.60) MAT2AALDH1A1KDM4EHPGDGAA
SCHEMBL13012739 0.69 BRD4 (0.46) MAT2AMAPK1ALDH1A1KDM4EHPGD

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