SCHEMBL6079234

SCHEMBL6079234

O=C(Nc1ccc(F)c(COc2cnccn2)c1)Nc1nnc(Cc2ccccc2)s1

nearest known ligand 0.54

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ ABL1 P00519 1/20 0.54
▸ ALDH1A1 P00352 1/20 0.53
▸ MEN1 O00255 10/20 0.52
▸ KMT2A Q03164 10/20 0.52
▸ MAPT P10636 5/20 0.48
▸ HTT P42858 2/20 0.47
▸ LMNA P02545 1/20 0.47
▸ MAPK1 P28482 1/20 0.46
▸ NPC1 O15118 1/20 0.46
▸ RAB9A P51151 1/20 0.46
▸ POLB P06746 1/20 0.45
▸ TSHR P16473 1/20 0.44

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
SCHEMBL6080735 0.89 BLM (0.55) ALDH1A1MEN1KMT2AMAPTHTT
SCHEMBL6079773 0.85 MAPT (0.44) ALDH1A1MEN1KMT2AMAPTHTT
SCHEMBL6270885 0.82 MAPT (0.41) ABL1MEN1KMT2AMAPTHTT
SCHEMBL6078723 0.82 BLM (0.43) MEN1KMT2AMAPTHTTLMNA
SCHEMBL6079674 0.82 RAB9A (0.49) ALDH1A1MEN1KMT2AMAPTHTT
SCHEMBL6204115 0.81 PTPRE (0.41) ALDH1A1MEN1KMT2AMAPTHTT
SCHEMBL6079515 0.80 BLM (0.42) ALDH1A1MEN1KMT2AMAPTHTT
SCHEMBL6079119 0.79 ALDH1A1 (0.52) ALDH1A1MEN1KMT2AMAPTHTT
SCHEMBL6078996 0.77 BRAF (0.50) ALDH1A1MAPTLMNANPC1RAB9A
SCHEMBL6084065 0.76 CNR1 (0.53) ABL1MEN1KMT2AMAPTHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060063782-A1 3-Hetero arylmethoxy ! pyridines and their analogues as p38 map kinase inhibitors ASTEX THERAPEUTICS LIMITED (GB) 2006-03-23 — — US disclosed
EP-1545523-A1 3-&-grave;(HETERO) ARYLMETHOXY ! PYRIDINES AND THEIR ANALOGUES ASP38 MAP KINASE INHIBITORS Astex Technology Limited (GB) 2005-06-29 — — EP disclosed
WO-2005002673-A1 RAF KINASE INHIBITORS ASTEX THERAPEUTICS LIMITED (GB) 2005-01-13 — — WO disclosed
WO-2004004720-A1 3-`(HETERO) ARYLMETHOXY ! PYRIDINES AND THEIR ANALOGUES AS P38 MAP KINASE INHIBITORS ASTEX TECHNOLOGY LIMITED (GB) 2004-01-15 — — WO 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-20060063782-A1 3-Hetero arylmethoxy ! pyridines and their analogues as p38 map kinase inhibitors MAPK1, MAPK3, MAPK10 ABL1 74/4885ALDH1A1 3196/4885MEN1 4610/4885

“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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