SCHEMBL30365647

SCHEMBL30365647

C[Si](C)(C)CCOCn1ncc2c(N=[N+]=[N-])ccnc21

nearest known ligand 0.31

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 1/20 0.31
▸ DGAT1 O75907 1/20 0.31
▸ ATR Q13535 1/20 0.30
▸ ATRIP Q8WXE1 1/20 0.30
▸ CYP17A1 P05093 1/20 0.30
▸ CYP1A2 P05177 1/20 0.30

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
SCHEMBL27200473 1.00 MAPT (0.31) MAPTDGAT1ATRATRIPCYP17A1
SCHEMBL27200482 0.82 CYP17A1 (0.35) MAPTDGAT1ATRATRIPCYP17A1
SCHEMBL30226522 0.79 CYP17A1 (0.35) MAPTDGAT1ATRATRIPCYP17A1
SCHEMBL30413120 0.79 DGAT1 (0.37) MAPTDGAT1ATRATRIPCYP17A1
SCHEMBL16793648 0.79 CYP17A1 (0.35) MAPTDGAT1ATRATRIPCYP17A1
SCHEMBL25324687 0.79 DGAT1 (0.37) MAPTDGAT1ATRATRIPCYP17A1
SCHEMBL25170860 0.78 — —
SCHEMBL29514122 0.77 MAPT (0.36) MAPTDGAT1ATRATRIPCYP17A1
SCHEMBL26720199 0.77 MAPT (0.36) MAPTDGAT1ATRATRIPCYP17A1
SCHEMBL29514366 0.73 UCHL1 (0.33) CYP17A1CYP1A2

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
EP-4182323-A1 PYRIDO OXAZINE AMINO DERIVATIVES AS ALK5 INHIBITORS Chiesi Farmaceutici S.p.A. (IT) 2023-05-24 — — EP disclosed
CN-116075307-A Pyridooxazine amino derivatives as ALK5 inhibitors 奇斯药制品公司 2023-05-05 — — CN disclosed
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