SCHEMBL30661958

SCHEMBL30661958

CS(=O)(=O)c1nc(Nc2ccc(F)c(Br)c2)cc(NC2CCNCC2)n1

nearest known ligand 0.61

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ KCNH2 Q12809 1/20 0.61
▸ MAPKAPK2 P49137 3/20 0.43
▸ APP P05067 1/20 0.37
▸ CDK2 P24941 2/20 0.36
▸ HTR6 P50406 6/20 0.36
▸ NMT1 P30419 1/20 0.35
▸ CTSL P07711 2/20 0.34
▸ CTSB P07858 2/20 0.34
▸ CTSS P25774 2/20 0.34
▸ CTSK P43235 2/20 0.34
▸ MAPK1 P28482 1/20 0.34
▸ PTGS2 P35354 3/20 0.34
▸ PTGS1 P23219 1/20 0.34
▸ PAK4 O96013 1/20 0.33
▸ SYK P43405 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
SCHEMBL30661964 0.88 KCNH2 (0.78) KCNH2MAPKAPK2CDK2HTR6
SCHEMBL30661965 0.84 KCNH2 (0.55) KCNH2MAPKAPK2APPHTR6NMT1
SCHEMBL25386410 0.80 KCNH2 (0.42) KCNH2HTR6
SCHEMBL30514112 0.80 KCNH2 (0.42) KCNH2HTR6
SCHEMBL30514108 0.74 KCNH2 (0.54) KCNH2MAPKAPK2CDK2PTGS2PTGS1
SCHEMBL25386906 0.74 KCNH2 (0.54) KCNH2MAPKAPK2CDK2PTGS2PTGS1
SCHEMBL29091990 0.73 KCNH2 (0.36) KCNH2SYK
SCHEMBL30661960 0.70 KCNH2 (0.71) KCNH2APPMAPK1PTGS2PTGS1
SCHEMBL14190734 0.69 HRH3 (0.59) NMT1CTSKMAPK1
SCHEMBL30661959 0.68 KCNH2 (0.49) KCNH2CDK2MAPK1PTGS2PTGS1

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-20230399320-A1 NOVEL CAPSID ASSEMBLY INHIBITOR Pelemed Co., Ltd. (UA) 2023-12-14 — — US claimed
EP-4242203-A1 NOVEL CAPSID ASSEMBLY INHIBITOR Pelemed Co., Ltd. (KR) 2023-09-13 — — EP claimed
US-20230399320-A1 NOVEL CAPSID ASSEMBLY INHIBITOR Pelemed Co., Ltd. (UA) 2023-12-14 — — US disclosed
EP-4242203-A1 NOVEL CAPSID ASSEMBLY INHIBITOR Pelemed Co., Ltd. (KR) 2023-09-13 — — EP 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-20230399320-A1 NOVEL CAPSID ASSEMBLY INHIBITOR ZC3HAV1, COPB1, CNBP KCNH2 3813/4885MAPKAPK2 1160/4885APP 559/4885

“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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