SCHEMBL488883

SCHEMBL488883

Clc1cccc(Cl)c1COc1cccnc1Nc1cncnc1

nearest known ligand 0.56

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SGMS2 Q8NHU3 8/20 0.56
SGMS1 Q86VZ5 5/20 0.56
SMN1; SMN2 Q16637 1/20 0.44
GCK P35557 5/20 0.43
GRM4 Q14833 1/20 0.41
PKM P14618 1/20 0.40
PPIA P62937 1/20 0.40
GRM5 P41594 1/20 0.39

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
SCHEMBL2337781 0.76 GCK (0.71) GCKGRM5
SCHEMBL28597283 0.73 SGMS2 (0.43) SGMS2SGMS1SMN1; SMN2GCKPKM
SCHEMBL28597282 0.73 SGMS2 (0.43) SGMS2SGMS1SMN1; SMN2GCKPKM
SCHEMBL29785266 0.72 SGMS2 (1.00) SGMS2SGMS1
SCHEMBL21266915 0.72 SGMS2 (1.00) SGMS2SGMS1
SCHEMBL9126609 0.72 PPIA (0.53) SGMS2SGMS1PPIA
SCHEMBL9126866 0.72 PPIA (0.52) SGMS2SGMS1SMN1; SMN2PPIA
SCHEMBL9127894 0.71 PPIA (0.55) SGMS2SGMS1SMN1; SMN2PPIA
SCHEMBL9124740 0.71 PPIA (0.55) SGMS2SGMS1SMN1; SMN2PPIA
SCHEMBL488951 0.70 NPC1 (0.61) SGMS2SGMS1SMN1; SMN2PKM

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-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-20070072874-A1 Aminoheteroaryl compounds as protein kinase inhibitors SUGEN, INC. 2007-03-29 US disclosed
US-20050009840-A1 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. 2005-01-13 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 (2 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-20050009840-A1 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 MET, ERBB2, CDK4 SGMS2 4017/4885SGMS1 3965/4885SMN1; SMN2 3718/4885
US-20070072874-A1 Aminoheteroaryl compounds as protein kinase inhibitors MET, MAP4K1, MAP4K2 SGMS2 4243/4885SGMS1 3876/4885SMN1; SMN2 4186/4885

“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.