SCHEMBL30616084

SCHEMBL30616084

COc1c(F)ccc(-c2cc3cc4nc(cc5ccc(cc6nc(cc2[nH]3)C=C6)[nH]5)C=C4)c1F

nearest known ligand 0.34

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ AMY1A P0DUB6 6/20 0.34
▸ STAT3 P40763 1/20 0.31
▸ STAT1 P42224 1/20 0.31
▸ ABL1 P00519 1/20 0.31
▸ FGFR1 P11362 1/20 0.31
▸ FLT1 P17948 1/20 0.31
▸ EPHA2 P29317 1/20 0.31
▸ EPHA4 P54764 1/20 0.31

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
SCHEMBL1271006 0.80 AMY1A (0.39) AMY1ASTAT3STAT1
SCHEMBL4383965 0.79 STAT3 (0.33) STAT3STAT1
SCHEMBL29209967 0.79 AMY1A (0.36) AMY1ASTAT3STAT1
SCHEMBL30472787 0.79 AMY1A (0.36) AMY1ASTAT3STAT1
SCHEMBL27477373 0.79 STAT3 (0.33) AMY1ASTAT3STAT1
SCHEMBL845873 0.79 AMY1A (0.38) AMY1ASTAT3STAT1
SCHEMBL30530985 0.79 FGFR1 (0.40) AMY1AFGFR1
SCHEMBL2950385 0.78 BRD4 (0.40) —
Hydrochloric Acid SCHEMBL8919400 0.78 AMY1A (0.38) AMY1A
Hydrochloric Acid SCHEMBL30472785 0.77 AMY1A (0.35) AMY1ASTAT3STAT1

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
CN-113474383-B Free radical polymerizable composition 波林复合材料美国股份有限公司 2023-10-31 — — CN disclosed
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