SCHEMBL487716

SCHEMBL487716

Nc1ncc(-c2ccc(NS(=O)(=O)CCN3CCCCC3)cc2)nc1OCc1c(F)ccc(F)c1Cl

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAP4K4 O95819 3/20 0.44
CSF1R P07333 3/20 0.42
MET P08581 5/20 0.40
HRH3 Q9Y5N1 1/20 0.39
ATR Q13535 3/20 0.38
SRC P12931 1/20 0.38
CCNE2 O96020 1/20 0.36
CCNE1 P24864 1/20 0.36
CDK2 P24941 1/20 0.36
GSK3B P49841 1/20 0.36
SGK1 O00141 1/20 0.35
ACVR1 Q04771 1/20 0.35

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
SCHEMBL30453212 1.00 MAP4K4 (0.44) MAP4K4CSF1RMETHRH3ATR
SCHEMBL487892 0.99 MAP4K4 (0.43) MAP4K4CSF1RMETHRH3ATR
SCHEMBL30453605 0.99 MAP4K4 (0.43) MAP4K4CSF1RMETHRH3ATR
SCHEMBL30454955 0.92 MAP4K4 (0.46) MAP4K4CSF1RMETATRSGK1
SCHEMBL488465 0.92 MAP4K4 (0.46) MAP4K4CSF1RMETATRSGK1
SCHEMBL488100 0.91 CSF1R (0.41) MAP4K4CSF1RMETSGK1ACVR1
SCHEMBL30452819 0.91 MAP4K4 (0.46) MAP4K4CSF1RMETATRSRC
SCHEMBL30452779 0.91 CSF1R (0.41) MAP4K4CSF1RMETSGK1ACVR1
SCHEMBL488090 0.91 MAP4K4 (0.46) MAP4K4CSF1RMETATRSRC
SCHEMBL30454893 0.90 MAP4K4 (0.45) MAP4K4CSF1RMETATRSRC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-4695588-B2 2011-06-08 JP claimed
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 MAP4K4 10/4885CSF1R 757/4885MET 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.