SCHEMBL27075636

SCHEMBL27075636

CN(C)c1cccc(Nc2c(-c3ccncc3)[nH]c3cnccc23)c1

nearest known ligand 0.48

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ KDM1A O60341 1/20 0.48
▸ ABCG2 Q9UNQ0 1/20 0.45
▸ NTRK1 P04629 1/20 0.43
▸ BUB1 O43683 15/20 0.42
▸ EGFR P00533 2/20 0.38
▸ ERBB2 P04626 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
SCHEMBL27075647 0.85 BUB1 (0.53) BUB1
SCHEMBL27075643 0.82 BUB1 (0.52) BUB1EGFRERBB2
SCHEMBL27075652 0.82 BUB1 (0.46) ABCG2BUB1
SCHEMBL27075644 0.82 BUB1 (0.55) BUB1
SCHEMBL27075649 0.80 MEN1 (0.47) NTRK1
SCHEMBL31356301 0.73 ABCG2 (0.48) KDM1AABCG2NTRK1EGFR
SCHEMBL31485477 0.72 ABCG2 (0.47) KDM1AABCG2NTRK1EGFR
SCHEMBL10571080 0.71 KDM1A (0.53) KDM1AABCG2NTRK1EGFR
SCHEMBL27075646 0.71 BUB1 (0.52) BUB1
SCHEMBL27075638 0.70 HTR6 (0.45) BUB1EGFR

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-11891390-B1 3-substituted amino-2-arylpyrrolo[2,3-c]pyridines as CK2 inhibitors King Faisal University (SA) 2024-02-06 — — 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-11891390-B1 3-substituted amino-2-arylpyrrolo[2,3-c]pyridines as CK2 inhibitors CSNK2A3, CSNK2A2, CSNK2A1 KDM1A 3593/4885ABCG2 3973/4885NTRK1 514/4885

“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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