SCHEMBL30398988

SCHEMBL30398988

O=C(NCc1ccnc(-n2cnc(C(F)(F)F)c2)c1)N[C@@H]1C[C@H]2CC[C@@H]1C2

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ EPHX2 P34913 6/20 0.41
▸ HPGD P15428 1/20 0.39
▸ NAMPT P43490 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.34
▸ TRPA1 O75762 1/20 0.34
▸ BTK Q06187 1/20 0.33
▸ GPR52 Q9Y2T5 1/20 0.33
▸ GCG P01275 1/20 0.33
▸ EPHX1 P07099 2/20 0.33
▸ MAPT P10636 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
SCHEMBL25613761 1.00 EPHX2 (0.41) EPHX2HPGDNAMPTALDH1A1TRPA1
SCHEMBL25303126 0.86 EPHX1 (0.38) HPGDNAMPTTRPA1GCGEPHX1
SCHEMBL25303130 0.86 EPHX1 (0.38) HPGDNAMPTTRPA1GCGEPHX1
SCHEMBL30398665 0.86 EPHX2 (0.48) EPHX2HPGDNAMPTALDH1A1BTK
SCHEMBL25614257 0.86 EPHX2 (0.48) EPHX2HPGDNAMPTALDH1A1BTK
SCHEMBL25295307 0.83 CA1 (0.48) EPHX2
SCHEMBL30399042 0.83 GCG (0.37) NAMPTTRPA1GPR52GCG
SCHEMBL25613749 0.83 GCG (0.37) NAMPTTRPA1GPR52GCG
SCHEMBL25639850 0.81 EPHX2 (0.43) EPHX2HPGDNAMPTALDH1A1EPHX1
SCHEMBL25238691 0.80 GLS (0.40) NAMPTTRPA1GPR52GCG

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
US-20250074901-A1 NOVEL HETEROARYL COMPOUNDS ANGELINI PHARMA S.P.A. (IT) 2025-03-06 — — US claimed
US-20250074901-A1 NOVEL HETEROARYL COMPOUNDS ANGELINI PHARMA S.P.A. (IT) 2025-03-06 — — US disclosed
EP-4433453-A1 NOVEL HETEROARYL-UREA COMPOUNDS AS KV7.2 INHIBITORS Icagen, LLC (US) 2024-09-25 — — EP disclosed
WO-2023091554-A1 NOVEL HETEROARYL-UREA COMPOUNDS AS KV7.2 INHIBITORS ICAGEN, LLC (US) 2023-05-25 — — WO 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 (1 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-20250074901-A1 NOVEL HETEROARYL COMPOUNDS H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, CYP3A43, F12 EPHX2 1961/4885HPGD 3809/4885NAMPT 2968/4885

“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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