SCHEMBL29210694

SCHEMBL29210694

CN(c1cccc(I)c1)c1nc(=NN)[nH]c2cc(Cl)c(F)cc12

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
EGFR P00533 1/20 0.33
ABCG2 Q9UNQ0 1/20 0.33
F2 P00734 1/20 0.31
F10 P00742 1/20 0.31
GRM4 Q14833 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
SCHEMBL23577203 1.00 EGFR (0.33) EGFRABCG2F2F10GRM4
SCHEMBL30013464 1.00 EGFR (0.33) EGFRABCG2F2F10GRM4
SCHEMBL29909805 1.00 EGFR (0.33) EGFRABCG2F2F10GRM4
SCHEMBL29909240 0.88 EGFR (0.41) EGFRABCG2F2F10
SCHEMBL23577087 0.88 EGFR (0.41) EGFRABCG2F2F10
SCHEMBL30013226 0.88 EGFR (0.41) EGFRABCG2F2F10
SCHEMBL29210603 0.88 EGFR (0.41) EGFRABCG2F2F10
SCHEMBL23577040 0.80 EGFR (0.43) EGFRABCG2GRM4
SCHEMBL30013725 0.80 EGFR (0.43) EGFRABCG2GRM4
SCHEMBL29210686 0.80 EGFR (0.43) EGFRABCG2GRM4

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-118324767-A Diacylglycerol kinase modulating compounds 卡尔那生物科学株式会社 2024-07-12 CN disclosed
CN-117736207-A Diacylglycerol kinase modulating compounds 卡尔那生物科学株式会社 2024-03-22 CN disclosed
CN-115362003-B Diacylglycerol kinase modulating compounds 卡尔那生物科学株式会社 2024-03-22 CN disclosed
CN-115362003-A Diacylglycerol kinase modulating compounds 卡尔那生物科学株式会社 2022-11-18 CN disclosed