SCHEMBL27382297

SCHEMBL27382297

CC(CC(=N)C(=O)OC(C)(C)C)n1cc(-c2ccc(O)cc2)c2c(N)ncnc21

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ SRC P12931 12/20 0.53
▸ KDR P35968 7/20 0.49
▸ TEK Q02763 6/20 0.49
▸ LCK P06239 4/20 0.49
▸ ABL1 P00519 1/20 0.47
▸ EGFR P00533 1/20 0.47
▸ ABL2 P42684 1/20 0.47
▸ PIK3CD O00329 1/20 0.46
▸ PIK3CA P42336 1/20 0.46
▸ PIK3CB P42338 1/20 0.46
▸ PIK3CG P48736 1/20 0.46
▸ PRKDC P78527 1/20 0.46
▸ RET P07949 1/20 0.45
▸ KIF5B P33176 1/20 0.45

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
SCHEMBL27381319 0.92 SRC (0.53) SRCKDRTEKLCKABL1
SCHEMBL28825829 0.82 DYRK3 (0.39) SRCKDRTEKLCKABL1
SCHEMBL2074398 0.76 PIK3CD (0.73) SRCKDRTEKLCKABL1
SCHEMBL28814503 0.76 FGFR2 (0.48) —
SCHEMBL27555108 0.73 TEK (0.74) SRCKDRTEKLCKEGFR
SCHEMBL27378709 0.72 PIK3CD (0.63) SRCKDRLCKABL1EGFR
SCHEMBL27399946 0.72 PIK3CD (0.66) SRCKDRLCKABL1EGFR
SCHEMBL27535239 0.71 SRC (0.58) SRCKDRTEKLCKABL1
SCHEMBL8107904 0.69 SRC (1.00) SRCKDRABL1EGFRABL2
SCHEMBL8107053 0.69 SRC (0.90) SRCKDRABL1EGFRABL2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1079796-C Novel N-7-heterocyclyl-pyrrolo [2, 3-d ] pyrimidines and their use NOVARTIS AG (CH) 2002-02-27 — — CN disclosed
CN-1216544-A Novel N-7-heterocyclyl pyrrolo [2,3-D] pyridines and their use NOVARTIS AG (CH) 1999-05-12 — — CN disclosed
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