SCHEMBL28923114

SCHEMBL28923114

CN(C)C(=O)Cc1ccc(NC(=O)c2cn([C@@H]3CCCNC3)c3ncnc(N)c23)cc1

nearest known ligand 0.62

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ RET P07949 19/20 0.62
▸ ERBB2 P04626 1/20 0.52
▸ LCK P06239 1/20 0.49
▸ SRC P12931 1/20 0.49

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
SCHEMBL28902625 1.00 RET (0.62) RETERBB2LCKSRC
SCHEMBL29926832 1.00 RET (0.62) RETERBB2LCKSRC
SCHEMBL28630028 0.85 ERBB2 (0.54) RETERBB2LCKSRC
SCHEMBL28630033 0.85 ERBB2 (0.54) RETERBB2LCKSRC
SCHEMBL29926948 0.85 ERBB2 (0.54) RETERBB2LCKSRC
SCHEMBL28630035 0.84 ERBB2 (0.61) RETERBB2
SCHEMBL28630026 0.84 ERBB2 (0.61) RETERBB2
SCHEMBL28923846 0.82 ERBB2 (0.75) RETERBB2
SCHEMBL28923847 0.82 ERBB2 (0.75) RETERBB2
SCHEMBL29926821 0.81 RET (0.58) RETERBB2SRC

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-113336760-B Substituted amide derivatives, compositions and uses thereof 深圳市塔吉瑞生物医药有限公司 2022-11-04 — — CN disclosed
CN-113336760-A Substituted amide derivatives, compositions and uses thereof 深圳市塔吉瑞生物医药有限公司 2021-09-03 — — CN disclosed
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