SCHEMBL29928103

SCHEMBL29928103

CNCc1cc(Oc2ccc(N3CCC(N)CC3)nc2)cc(-c2cc(Cl)cc(Cl)c2)c1

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ FURIN P09958 6/20 0.39
▸ SSTR2 P30874 2/20 0.38
▸ RET P07949 6/20 0.38
▸ MAPK8 P45983 1/20 0.34
▸ MELK Q14680 2/20 0.34
▸ KCNH2 Q12809 1/20 0.34
▸ PRMT5 O14744 1/20 0.34
▸ MCHR1 Q99705 1/20 0.34

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
SCHEMBL21550748 1.00 FURIN (0.39) FURINSSTR2RETMAPK8MELK
SCHEMBL29928375 0.87 FURIN (0.41) FURIN
SCHEMBL21551365 0.87 FURIN (0.41) FURIN
SCHEMBL21553814 0.86 NTRK1 (0.38) FURINRET
SCHEMBL29928441 0.86 NTRK1 (0.38) FURINRET
SCHEMBL21550802 0.83 ZAP70 (0.38) FURINRET
SCHEMBL29927882 0.83 ZAP70 (0.38) FURINRET
SCHEMBL21550637 0.82 CHRNB2 (0.36) FURINKCNH2
SCHEMBL29928059 0.82 CHRNB2 (0.36) FURINKCNH2
SCHEMBL21551606 0.82 FURIN (0.49) FURINSSTR2KCNH2

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-112384509-B Furin inhibitors 葛兰素史密斯克莱知识产权发展有限公司 2024-04-30 — — CN claimed
EP-4058021-A1 SMALL MOLECULE FURIN INHIBITORS FOR TREATING INFECTIOUS DISEASES BP Asset V, Inc. (US) 2022-09-21 — — EP claimed
CN-112384509-B Furin inhibitors 葛兰素史密斯克莱知识产权发展有限公司 2024-04-30 — — CN disclosed
US-20230011571-A1 SMALL MOLECULE FURIN INHIBITORS FOR TREATING INFECTIOUS DISEASES BP ASSET V, INC. (US) 2023-01-12 — — US 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-20230011571-A1 SMALL MOLECULE FURIN INHIBITORS FOR TREATING INFECTIOUS DISEASES FURIN, LGMN, PLAU FURIN 1/4885SSTR2 4645/4885RET 290/4885

“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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