SCHEMBL21209372

SCHEMBL21209372

Cc1nc2cnccn2c1-c1ccnc(N2CCNCC2)c1

nearest known ligand 0.49

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CSNK1E P49674 1/20 0.49
KARS1 Q15046 4/20 0.46
DYRK1A Q13627 1/20 0.46
NMT1 P30419 10/20 0.46
TLR9 Q9NR96 2/20 0.43
TLR8 Q9NR97 2/20 0.43
TLR7 Q9NYK1 2/20 0.43

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
SCHEMBL21209364 0.89 DRD1 (0.41) CSNK1ENMT1
SCHEMBL21209380 0.87 KDM4E (0.47)
SCHEMBL21208129 0.85 CSNK1E (0.47) CSNK1EKARS1DYRK1ANMT1TLR9
SCHEMBL21211450 0.83 CYP1A2 (0.51) CSNK1E
SCHEMBL21209777 0.81 CSNK1E (0.47) CSNK1EKARS1
SCHEMBL24688736 0.76 CSNK1E (0.56) CSNK1EKARS1DYRK1ANMT1TLR9
SCHEMBL21208130 0.74 CDK2 (0.48) NMT1
SCHEMBL21217063 0.72 PRKDC (0.52) CSNK1E
SCHEMBL21208646 0.71 ALDH1A1 (0.42)
SCHEMBL21208926 0.70 TSHR (0.43)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10988477-B2 GCN2 inhibitors and uses thereof MERCK PATENT GMBH (DE) 2021-04-27 US disclosed
WO-2019148132-A1 GCN2 INHIBITORS AND USES THEREOF MERCK PATENT GMBH (DE) 2019-08-01 WO disclosed
US-20190233425-A1 GCN2 INHIBITORS AND USES THEREOF MERCK PATENT GMBH (DE) 2019-08-01 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 (2 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-10988477-B2 GCN2 inhibitors and uses thereof EIF2AK4, GCN1, EIF2AK1 CSNK1E 431/4885KARS1 1965/4885DYRK1A 1956/4885
US-20190233425-A1 GCN2 INHIBITORS AND USES THEREOF EIF2AK4, GCN1, GCGR CSNK1E 1424/4885KARS1 2649/4885DYRK1A 4540/4885

“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.