SCHEMBL30035472

SCHEMBL30035472

C[C@H]1C[C@@H](n2cc(C(=O)O)c3c(N)ncnc32)CN1C(=O)OC(C)(C)C

nearest known ligand 0.59

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ SRC P12931 20/20 0.59
▸ EGFR P00533 2/20 0.51
▸ ABL1 P00519 1/20 0.46
▸ ABL2 P42684 1/20 0.46

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
SCHEMBL27194876 1.00 SRC (0.59) SRCEGFRABL1ABL2
SCHEMBL25417491 1.00 SRC (0.59) SRCEGFRABL1ABL2
SCHEMBL30035929 0.87 SRC (0.58) SRCEGFRABL1ABL2
SCHEMBL31463180 0.87 SRC (0.58) SRCEGFRABL1ABL2
SCHEMBL19180435 0.81 SRC (0.49) SRCEGFRABL1
SCHEMBL28627629 0.80 SRC (0.66) SRCEGFRABL1ABL2
SCHEMBL29926654 0.80 SRC (0.66) SRCEGFRABL1ABL2
SCHEMBL28627632 0.80 SRC (0.66) SRCEGFRABL1ABL2
SCHEMBL25390196 0.76 SRC (0.46) SRCEGFR
SCHEMBL26791254 0.75 SRC (0.64) SRCEGFRABL1ABL2

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
CN-116249534-B Crystallization of pyrimidine compounds 大鹏药品工业株式会社 2025-03-25 — — CN disclosed
CN-113271950-B Pyrimidine compound or salt thereof 大鹏药品工业株式会社 2024-04-30 — — CN disclosed
EP-4351737-A2 TREATMENT METHODS FOR SUBJECTS WITH CANCER HAVING AN ABERRATION IN EGFR AND/OR HER2 Taiho Pharmaceutical Co., Ltd. (JP) 2024-04-17 — — EP disclosed
WO-2022251095-A2 TREATMENT METHODS FOR SUBJECTS WITH CANCER HAVING AN ABERRATION IN EGFR AND/OR HER2 TAIHO PHARMACEUTICAL CO., LTD. (JP) 2022-12-01 — — WO disclosed
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