SCHEMBL10217929

SCHEMBL10217929

COc1ccccc1-c1nc(COc2cc(-c3ccc(C(=O)N4CCC(N5CCCC5)CC4)cc3)cnc2N)c(C)o1

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ MERTK Q12866 4/20 0.48
▸ AXL P30530 3/20 0.48
▸ MET P08581 7/20 0.48
▸ AVPR2 P30518 1/20 0.44
▸ AVPR1A P37288 1/20 0.44
▸ ATR Q13535 1/20 0.44
▸ TP53 P04637 2/20 0.43
▸ MAPT P10636 1/20 0.42
▸ TSHR P16473 1/20 0.42
▸ MAPK1 P28482 1/20 0.42
▸ HSD17B10 Q99714 1/20 0.42
▸ EIF4E P06730 1/20 0.41
▸ MKNK1 Q9BUB5 1/20 0.41
▸ MKNK2 Q9HBH9 1/20 0.41
▸ MAPK7 Q13164 1/20 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
SCHEMBL10217856 0.91 MET (0.51) MERTKAXLMETAVPR2AVPR1A
SCHEMBL10217920 0.89 MET (0.54) MERTKAXLMETAVPR2AVPR1A
SCHEMBL10217455 0.87 MET (0.49) MERTKAXLMETAVPR2AVPR1A
SCHEMBL10217937 0.87 MET (0.52) MERTKAXLMETAVPR2AVPR1A
SCHEMBL488733 0.81 MET (0.56) MERTKAXLMETAVPR2AVPR1A
SCHEMBL30453025 0.81 MET (0.56) MERTKAXLMETAVPR2AVPR1A
SCHEMBL10217716 0.80 MET (0.54) MERTKAXLMETAVPR2AVPR1A
SCHEMBL10217904 0.80 MET (0.54) MERTKAXLMETATR
SCHEMBL10217797 0.80 MET (0.54) MERTKAXLMETAVPR2AVPR1A
SCHEMBL10217914 0.80 MET (0.55) MERTKAXLMETAVPR2AVPR1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8106197-B2 Aminoheteroaryl compounds as protein kinase inhibitors PFIZER INC. (US) 2012-01-31 — — US disclosed
US-8106197-B2 Aminoheteroaryl compounds as protein kinase inhibitors PFIZER INC. (US) 2012-01-31 — — US disclosed
US-7230098-B2 2-amino- pyridines and pyrazines additionally substituted witn one or more carbocyclic or heterocyclic groups, e.g., 4-[6-amino-5-(2,6-dichloro-benzyloxy)-pyridin-3-yl]-phenol, for treating many kinds of cancer SUGEN, INC. (US) 2007-06-12 — — US disclosed
US-7230098-B2 2-amino- pyridines and pyrazines additionally substituted witn one or more carbocyclic or heterocyclic groups, e.g., 4-[6-amino-5-(2,6-dichloro-benzyloxy)-pyridin-3-yl]-phenol, for treating many kinds of cancer SUGEN, INC. (US) 2007-06-12 — — US disclosed
US-20070072874-A1 Aminoheteroaryl compounds as protein kinase inhibitors SUGEN, INC. 2007-03-29 — — US disclosed
US-20070072874-A1 Aminoheteroaryl compounds as protein kinase inhibitors SUGEN, INC. 2007-03-29 — — 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-20070072874-A1 Aminoheteroaryl compounds as protein kinase inhibitors MET, MAP4K1, MAP4K2 MERTK 69/4885AXL 623/4885MET 1/4885

“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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