SCHEMBL24415499

SCHEMBL24415499

COC(=O)c1cnc(N)[nH]1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 1/20 0.49
MAPK1 P28482 3/20 0.46
TSHR P16473 1/20 0.44
CYP1A2 P05177 2/20 0.42
KDM4E B2RXH2 5/20 0.41
GAA P10253 3/20 0.41
GLA P06280 2/20 0.41
ALDH1A1 P00352 4/20 0.40
XDH P47989 1/20 0.38
HSD17B10 Q99714 3/20 0.37
HPGD P15428 2/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
ABL1 P00519 2/20 0.36
CFTR P13569 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
SRC P12931 1/20 0.36
GABRP O00591 1/20 0.36
GABRD O14764 1/20 0.36
PDE5A O76074 1/20 0.36

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
SCHEMBL369489 0.80 ALDH1A1 (0.49) MMP2CYP1A2KDM4EGAAGLA
SCHEMBL4251404 0.78 MMP2 (0.50) MMP2MAPK1TSHRCYP1A2KDM4E
SCHEMBL20534022 0.77 MMP2 (0.49) MMP2MAPK1TSHRCYP1A2KDM4E
SCHEMBL18626490 0.77 MMP2 (0.49) MMP2MAPK1TSHRCYP1A2KDM4E
SCHEMBL11392770 0.77 MMP2 (0.49) MMP2MAPK1TSHRCYP1A2KDM4E
SCHEMBL20630811 0.77 MMP2 (0.60) MMP2MAPK1TSHRCYP1A2KDM4E
SCHEMBL14738345 0.75 MMP2 (0.48) MMP2MAPK1TSHRCYP1A2KDM4E
SCHEMBL14744177 0.75 MMP2 (0.67) MMP2MAPK1TSHRCYP1A2KDM4E
SCHEMBL7424608 0.74 MMP2 (0.61) MMP2MAPK1TSHRCYP1A2KDM4E
SCHEMBL8225066 0.74 MMP2 (0.50) MMP2MAPK1TSHRCYP1A2KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022095989-A1 P300 INHIBITORS AND USE THEREOF IN MEDICINE 贝达药业股份有限公司 2022-05-12 WO disclosed