SCHEMBL487848

SCHEMBL487848

Nc1ncc(-c2ccc3[nH]c(C(=O)NCC(O)CN4CCCC4)cc3c2)cc1OCc1c(Cl)cccc1Cl

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MET P08581 5/20 0.49
DRD3 P35462 15/20 0.46
DRD2 P14416 11/20 0.46
DRD4 P21917 10/20 0.44
HTR1A P08908 6/20 0.43
HTR2A P28223 6/20 0.43
HTR2C P28335 4/20 0.43
DRD1 P21728 2/20 0.43
KCNH2 Q12809 1/20 0.43

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
SCHEMBL30453696 1.00 MET (0.49) METDRD3DRD2DRD4HTR1A
SCHEMBL487484 0.88 MET (0.51) METDRD3DRD2DRD4HTR1A
SCHEMBL30452667 0.88 MET (0.51) METDRD3DRD2DRD4HTR1A
SCHEMBL487541 0.86 MET (0.60) METDRD3DRD2DRD4HTR1A
SCHEMBL30454277 0.86 MET (0.60) METDRD3DRD2DRD4HTR1A
SCHEMBL487898 0.82 MET (0.58) METDRD3DRD2DRD4HTR1A
SCHEMBL30452739 0.82 MET (0.58) METDRD3DRD2DRD4HTR1A
SCHEMBL488203 0.80 MET (0.61) MET
SCHEMBL30452997 0.80 MET (0.61) MET
SCHEMBL489166 0.79 MET (0.76) MET

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 7 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-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 MET 1/4885DRD3 4455/4885DRD2 4115/4885

“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.