SCHEMBL23356121

SCHEMBL23356121

Nc1n[nH]c2nc(Nc3cccc(C(F)(F)F)c3F)c(F)cc12

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 2/20 0.43
▸ KDR P35968 2/20 0.41
▸ ULK1 O75385 2/20 0.38
▸ RIPK1 Q13546 1/20 0.35
▸ AR P10275 1/20 0.35
▸ MPL P40238 2/20 0.34
▸ EPHX2 P34913 1/20 0.34
▸ SGK1 O00141 1/20 0.33
▸ AXL P30530 1/20 0.33
▸ PIK3CA P42336 2/20 0.33
▸ PIK3CB P42338 2/20 0.33
▸ PIK3CG P48736 2/20 0.33
▸ EPHA2 P29317 1/20 0.33
▸ EPHB4 P54760 1/20 0.33
▸ PIK3CD O00329 1/20 0.33

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
SCHEMBL30791233 1.00 EGFR (0.43) EGFRKDRULK1RIPK1AR
SCHEMBL30791247 0.88 EGFR (0.35) EGFRKDRULK1EPHX2PIK3CA
SCHEMBL23369587 0.88 DHODH (0.42) EGFRKDRULK1PIK3CAPIK3CB
SCHEMBL23356058 0.88 EGFR (0.35) EGFRKDRULK1EPHX2PIK3CA
SCHEMBL30791216 0.85 SGK1 (0.33) KDRSGK1
SCHEMBL23356099 0.85 SGK1 (0.33) KDRSGK1
SCHEMBL30791280 0.84 TRPA1 (0.34) EGFRKDRULK1SGK1PIK3CA
SCHEMBL23356081 0.84 TRPA1 (0.34) EGFRKDRULK1SGK1PIK3CA
SCHEMBL23356027 0.83 GRM4 (0.47) EGFRKDRSGK1
SCHEMBL30791242 0.83 GRM4 (0.47) EGFRKDRSGK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12583852-B2 Heterocycle derivative JW PHARMACEUTICAL CORPORATION (KR) 2026-03-24 — — US disclosed
CN-112313232-B Novel heterocyclic derivatives JW中外制药公司 2024-03-08 — — CN disclosed
US-20220259199-A1 NOVEL HETEROCYCLE DERIVATIVE JW PHARMACEUTICAL CORPORATION (KR) 2022-08-18 — — US disclosed
EP-3822270-A1 NOVEL HETEROCYCLE DERIVATIVE JW Pharmaceutical Corporation (KR) 2021-05-19 — — EP disclosed
CN-112313232-A Novel heterocyclic derivatives JW中外制药公司 2021-02-02 — — CN disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-12583852-B2 Heterocycle derivative AR, SRD5A1, NR5A1 EGFR 787/4885KDR 4174/4885ULK1 3625/4885
US-20220259199-A1 NOVEL HETEROCYCLE DERIVATIVE AR, BRDT, NR5A1 EGFR 1730/4885KDR 4122/4885ULK1 2467/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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