SCHEMBL5464639

SCHEMBL5464639

CCc1cc(C)nc(N2CCCC(CO)C2)n1

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 7/20 0.49
▸ ALDH1A1 P00352 3/20 0.49
▸ HSD17B10 Q99714 2/20 0.49
▸ MEN1 O00255 1/20 0.49
▸ KMT2A Q03164 1/20 0.49
▸ KHK P50053 1/20 0.44
▸ GAA P10253 2/20 0.44
▸ TSHR P16473 2/20 0.44
▸ LMNA P02545 1/20 0.43
▸ MAPT P10636 1/20 0.43
▸ PIK3CA P42336 1/20 0.42
▸ MTOR P42345 1/20 0.42
▸ POLB P06746 2/20 0.41
▸ RBP4 P02753 1/20 0.41
▸ TTR P02766 1/20 0.41
▸ IGF1R P08069 1/20 0.40

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
SCHEMBL5447893 0.84 KDM4E (0.48) KDM4EALDH1A1HSD17B10GAATSHR
SCHEMBL27681017 0.80 RBP4 (0.61) KDM4EALDH1A1HSD17B10MEN1KMT2A
SCHEMBL5457627 0.76 ALDH1A1 (0.40) KDM4EALDH1A1HSD17B10MEN1KMT2A
SCHEMBL24656055 0.72 KHK (0.49) KDM4EKMT2AKHKPIK3CAMTOR
SCHEMBL15107946 0.72 SORD (0.45) KDM4EALDH1A1HSD17B10MEN1KMT2A
SCHEMBL13033928 0.72 CASP1 (0.47) KDM4EALDH1A1MEN1KMT2AMAPT
SCHEMBL14428506 0.69 MAP4K4 (0.43) KDM4EALDH1A1KMT2AKHKPOLB
SCHEMBL18781075 0.69 KDM4E (0.44) KDM4EALDH1A1HSD17B10MEN1KMT2A
SCHEMBL1688142 0.68 KHK (0.50) ALDH1A1KMT2AKHKPIK3CAMTOR
SCHEMBL1839601 0.67 TYMP (0.45) KDM4EALDH1A1KMT2AKHKPIK3CA

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-20070259849-A1 Azine-Carboxamides as Anti-Cancer Agents ASTRAZENECA AB (SE) 2007-11-08 — — 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-20070259849-A1 Azine-Carboxamides as Anti-Cancer Agents ARAF, BRAF, RAF1 KDM4E 521/4885ALDH1A1 309/4885HSD17B10 4741/4885

“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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