SCHEMBL29933902

SCHEMBL29933902

COC(=O)c1ccc(F)c(C=C(F)F)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ERN1 O75460 2/20 0.49
CA1 P00915 3/20 0.46
CA2 P00918 3/20 0.46
CA12 O43570 2/20 0.46
CA7 P43166 2/20 0.46
CA9 Q16790 2/20 0.46
CA14 Q9ULX7 2/20 0.46
XDH P47989 2/20 0.46
MAPT P10636 4/20 0.43
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
CASP3 P42574 1/20 0.43
SENP7 Q9BQF6 1/20 0.43
KDM4E B2RXH2 4/20 0.42
ALDH1A1 P00352 3/20 0.42
HPGD P15428 2/20 0.42
HSD17B10 Q99714 2/20 0.42
GAA P10253 2/20 0.42
GLA P06280 1/20 0.42
CASP1 P29466 1/20 0.42

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
SCHEMBL28884715 1.00 ERN1 (0.49) ERN1CA1CA2CA12CA7
SCHEMBL23501652 0.84 NOTUM (0.48) ERN1CA1CA2CA12CA7
SCHEMBL29934039 0.84 NOTUM (0.48) ERN1CA1CA2CA12CA7
SCHEMBL459873 0.83 ERN1 (0.62) ERN1CA1CA2CA12CA7
SCHEMBL4129229 0.82 ERN1 (0.50) ERN1CA1CA2CA12CA7
SCHEMBL29933896 0.79 MAPK1 (0.40) ERN1CA1CA2CA12CA7
SCHEMBL28884628 0.79 MAPK1 (0.40) ERN1CA1CA2CA12CA7
SCHEMBL30628770 0.78 MAPT (0.45) CA1CA2CA12CA7CA9
SCHEMBL14012582 0.77 CES2 (0.59) ERN1CA1CA2CA12CA7
SCHEMBL29664708 0.77 CES2 (0.59) ERN1CA1CA2CA12CA7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119371371-A Compounds and compositions as PDGF receptor kinase inhibitors 日本新药株式会社 2025-01-28 CN disclosed
CN-115315421-B Compounds and compositions as PDGF receptor kinase inhibitors 日本新药株式会社 2024-12-03 CN disclosed
CN-115315421-A Compounds and compositions as PDGF receptor kinase inhibitors 日本新药株式会社 2022-11-08 CN disclosed