SCHEMBL30398893

SCHEMBL30398893

O=C(NCc1ccnc(Br)c1)N[C@@H]1C[C@H]2CC[C@@H]1C2

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ EPHX2 P34913 6/20 0.48
▸ NAMPT P43490 1/20 0.43
▸ EPHX1 P07099 2/20 0.41
▸ MAPT P10636 1/20 0.41
▸ HPGD P15428 4/20 0.40
▸ NPC1 O15118 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ ALDH1A1 P00352 2/20 0.38
▸ KDM4E B2RXH2 1/20 0.38
▸ TSHR P16473 1/20 0.38
▸ HSD17B10 Q99714 1/20 0.38
▸ P2RX7 Q99572 1/20 0.38

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
SCHEMBL25615170 1.00 EPHX2 (0.48) EPHX2NAMPTEPHX1MAPTHPGD
SCHEMBL25615176 1.00 EPHX2 (0.48) EPHX2NAMPTEPHX1MAPTHPGD
SCHEMBL25638890 0.85 EPHX2 (0.45) EPHX2NAMPTMAPTHPGDSMN1; SMN2
SCHEMBL25615095 0.85 EPHX2 (0.45) EPHX2NAMPTMAPTHPGDSMN1; SMN2
SCHEMBL30399847 0.85 EPHX2 (0.45) EPHX2NAMPTMAPTHPGDSMN1; SMN2
SCHEMBL25614257 0.84 EPHX2 (0.48) EPHX2NAMPTEPHX1MAPTHPGD
SCHEMBL30398665 0.84 EPHX2 (0.48) EPHX2NAMPTEPHX1MAPTHPGD
SCHEMBL30399057 0.83 EPHX2 (0.45) EPHX2NAMPTEPHX1MAPTHPGD
SCHEMBL30399998 0.83 EPHX2 (0.45) EPHX2NAMPTEPHX1MAPTHPGD
SCHEMBL25614788 0.83 EPHX2 (0.45) EPHX2NAMPTEPHX1MAPTHPGD

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-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
CN-118525003-A Novel heteroaryl urea compounds as KV7.2 inhibitors 伊卡根有限责任公司 2024-08-20 — — CN 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 1961/4885NAMPT 2968/4885EPHX1 2533/4885

“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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