SCHEMBL27075643

SCHEMBL27075643

Clc1cccc(Nc2c(-c3ccncc3)[nH]c3cnccc23)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BUB1 O43683 2/20 0.52
▸ TDO2 P48775 2/20 0.51
▸ IDO1 P14902 1/20 0.51
▸ KDM4E B2RXH2 1/20 0.47
▸ ERBB2 P04626 2/20 0.46
▸ PTK6 Q13882 2/20 0.46
▸ CHUK O15111 1/20 0.44
▸ PIM1 P11309 3/20 0.43
▸ PIM2 Q9P1W9 3/20 0.43
▸ MAPK13 O15264 1/20 0.43
▸ RAF1 P04049 1/20 0.43
▸ MAPK12 P53778 1/20 0.43
▸ MAPK11 Q15759 1/20 0.43
▸ MAPK14 Q16539 1/20 0.43
▸ FADS1 O60427 1/20 0.42
▸ MEN1 O00255 1/20 0.42
▸ ALDH1A1 P00352 1/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ ROCK2 O75116 1/20 0.42
▸ ABL1 P00519 2/20 0.41

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) BUB1MAPK14MEN1KMT2AABL1
SCHEMBL27075640 0.84 IDO1 (0.50) BUB1TDO2IDO1ERBB2PTK6
SCHEMBL27075644 0.82 BUB1 (0.55) BUB1TDO2IDO1
SCHEMBL27075636 0.82 KDM1A (0.48) BUB1ERBB2EGFR
SCHEMBL27075654 0.80 MAPK1 (0.48) CHUKMAPK13RAF1MAPK12MAPK11
SCHEMBL27075633 0.78 MEN1 (0.52) KDM4ECHUKPIM1MEN1KMT2A
SCHEMBL27075652 0.78 BUB1 (0.46) BUB1KDM4EMEN1KMT2A
SCHEMBL27075646 0.73 BUB1 (0.52) BUB1TDO2IDO1KDM4ECHUK
SCHEMBL4785768 0.72 FADS1 (0.71) TDO2IDO1PIM1PIM2FADS1
SCHEMBL27215791 0.71 PIM1 (0.51) KDM4EERBB2PTK6PIM1PIM2

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 BUB1 407/4885TDO2 427/4885IDO1 1592/4885

“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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