SCHEMBL27199808

SCHEMBL27199808

CN1CCN(CCNc2nc3ccncc3c3[nH]c4ccncc4c23)CC1

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ PGK1 P00558 6/20 0.40
▸ EGFR P00533 2/20 0.39
▸ KAT2B Q92831 1/20 0.39
▸ TERT O14746 1/20 0.38
▸ SLC2A1 P11166 1/20 0.38
▸ TLR9 Q9NR96 3/20 0.37
▸ MEN1 O00255 1/20 0.37
▸ LMNA P02545 1/20 0.37
▸ CYP1A2 P05177 1/20 0.37
▸ CYP3A4 P08684 1/20 0.37
▸ CYP2D6 P10635 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ NQO1 P15559 1/20 0.37
▸ GSK3A P49840 1/20 0.37
▸ GSK3B P49841 1/20 0.37
▸ FGFR1 P11362 1/20 0.37
▸ KDR P35968 1/20 0.37
▸ KDM4E B2RXH2 1/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37

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
SCHEMBL27199817 0.94 EGFR (0.46) PGK1EGFRSLC2A1NQO1GSK3A
SCHEMBL31485516 0.81 CHEK1 (0.40) PGK1EGFRKAT2BSLC2A1TLR9
SCHEMBL27092617 0.80 KAT2B (0.42) PGK1EGFRKAT2BTERTTLR9
SCHEMBL27199814 0.79 CSNK2A1 (0.48) EGFRTERTTLR9NQO1GSK3A
SCHEMBL27199811 0.78 TERT (0.50) EGFRTERTSLC2A1KMT2ANQO1
SCHEMBL27075672 0.77 KAT2B (0.41) PGK1KAT2BTLR9KDM4E
SCHEMBL27171386 0.76 EGFR (0.49) EGFRTERTSLC2A1FGFR1KDR
SCHEMBL30804528 0.76 KAT2B (0.45) PGK1EGFRKAT2BSLC2A1TLR9
SCHEMBL27074296 0.76 CSNK2A1 (0.47) —
SCHEMBL27165745 0.75 CSNK2A1 (0.45) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11964976-B1 Substituted pyrido[3′,4′:4,5]pyrrolo[3,2-c][1,6]naphthyridines as CK2 inhibitors King Faisal University (SA) 2024-04-23 — — 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-11964976-B1 Substituted pyrido[3′,4′:4,5]pyrrolo[3,2-c][1,6]naphthyridines as CK2 inhibitors CKS2, CDK2, CDK1 PGK1 53/4885EGFR 569/4885KAT2B 3943/4885

“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.

Send feedback