SCHEMBL26148251

SCHEMBL26148251

Cc1nn(CC=O)c2ncnc(N)c12

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 3/20 0.42
▸ KDM4E B2RXH2 2/20 0.42
▸ CYP1A2 P05177 2/20 0.42
▸ TP53 P04637 1/20 0.42
▸ CYP3A4 P08684 1/20 0.42
▸ PIK3CD O00329 6/20 0.41
▸ PRKDC P78527 6/20 0.41
▸ PIK3CA P42336 4/20 0.41
▸ PIK3CB P42338 4/20 0.41
▸ PIK3CG P48736 4/20 0.41
▸ SRC P12931 4/20 0.40
▸ EGFR P00533 4/20 0.40
▸ ABL1 P00519 3/20 0.40
▸ HCK P08631 3/20 0.40
▸ KDR P35968 3/20 0.40
▸ MTOR P42345 3/20 0.40
▸ EPHB4 P54760 3/20 0.40
▸ PI4KB Q9UBF8 2/20 0.40
▸ TSHR P16473 1/20 0.40
▸ HTT P42858 1/20 0.40

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
SCHEMBL21028946 0.84 PIK3CD (0.55) MAPK1KDM4ECYP1A2TP53CYP3A4
SCHEMBL18250087 0.83 DYRK3 (0.47) MAPK1PIK3CDPRKDCPIK3CAPIK3CB
SCHEMBL18250083 0.81 KDM4E (0.68) MAPK1KDM4ECYP1A2TP53CYP3A4
SCHEMBL10261498 0.80 PIK3CD (0.53) MAPK1KDM4ECYP1A2TP53CYP3A4
SCHEMBL10261070 0.76 SRC (0.52) MAPK1KDM4ECYP1A2TP53CYP3A4
SCHEMBL22215343 0.75 PIK3CD (0.55) MAPK1KDM4ECYP1A2TP53CYP3A4
SCHEMBL24096871 0.74 SRC (0.45) MAPK1KDM4ECYP1A2TP53CYP3A4
SCHEMBL24096856 0.74 RET (0.55) MAPK1KDM4ECYP1A2TP53CYP3A4
SCHEMBL25113285 0.74 RET (0.43) MAPK1KDM4ECYP1A2TP53CYP3A4
SCHEMBL18250076 0.74 ABL1 (0.59) PIK3CDPRKDCPIK3CAPIK3CBPIK3CG

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-2023083373-A1 COMPOUND USED AS SRC INHIBITOR 微境生物医药科技(上海)有限公司 2023-05-19 — — WO disclosed
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