SCHEMBL21960357

SCHEMBL21960357

CNC(=O)c1cc(N)nn1C1CCCC1

nearest known ligand 0.44

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ PDE7A Q13946 12/20 0.44
▸ RET P07949 6/20 0.41
▸ KDR P35968 5/20 0.41
▸ PIK3CD O00329 1/20 0.38
▸ MAP3K14 Q99558 1/20 0.36

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
SCHEMBL21960344 0.77 PDE7A (0.43) PDE7ARETKDR
SCHEMBL21960901 0.77 KDM4E (0.41) PDE7APIK3CDMAP3K14
SCHEMBL22424005 0.73 BAZ2B (0.47) —
SCHEMBL26416280 0.72 PKM (0.47) PDE7APIK3CD
SCHEMBL31052495 0.71 HPGD (0.43) PDE7AKDRPIK3CD
SCHEMBL20489182 0.71 BRD4 (0.45) PDE7A
SCHEMBL21960851 0.70 MAP3K14 (0.39) MAP3K14
SCHEMBL25083966 0.70 KMT2A (0.44) PDE7APIK3CD
SCHEMBL21960888 0.70 BAZ2B (0.39) PDE7ARETKDRMAP3K14
SCHEMBL10282157 0.69 HPGD (0.45) PDE7A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11136311-B2 Heteroaromatic derivatives as NIK inhibitors JANSSEN PHARMACEUTICA NV (BE) 2021-10-05 — — US disclosed
EP-3478675-B1 HETEROAROMATIC DERIVATIVES AS NIK INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2020-04-22 — — 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-11136311-B2 Heteroaromatic derivatives as NIK inhibitors NFKBIA, IKBKG, IKBKE PDE7A 2625/4885RET 1416/4885KDR 2851/4885

“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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