SCHEMBL3067848

SCHEMBL3067848

NCC[C@H](O)C(=O)N1CCCC1

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
DPP7 Q9UHL4 11/20 0.56
CPB2 Q96IY4 1/20 0.36
DPP4 P27487 7/20 0.36
MMP1 P03956 1/20 0.36
MMP2 P08253 1/20 0.36
MMP8 P22894 1/20 0.36
FAP Q12884 1/20 0.36
DPP8 Q6V1X1 1/20 0.36
DPP9 Q86TI2 1/20 0.36
ATM Q13315 1/20 0.35
ALDH1A1 P00352 1/20 0.34

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
SCHEMBL5323766 0.83 DPP7 (0.46) DPP7DPP4MMP1MMP2MMP8
SCHEMBL5323770 0.83 DPP7 (0.46) DPP7DPP4MMP1MMP2MMP8
SCHEMBL16964809 0.82 CYP3A4 (0.41) DPP7MMP1MMP8ALDH1A1
SCHEMBL3056306 0.82 CYP3A4 (0.41) DPP7MMP1MMP8ALDH1A1
SCHEMBL8487636 0.79 L3MBTL1 (0.42) DPP7DPP4MMP1MMP2MMP8
SCHEMBL6820919 0.78 DPP7 (0.59) DPP7DPP4FAPDPP8DPP9
SCHEMBL1063045 0.78 DPP7 (0.59) DPP7DPP4FAPDPP8DPP9
SCHEMBL1063047 0.78 DPP7 (0.59) DPP7DPP4FAPDPP8DPP9
SCHEMBL8489074 0.78 L3MBTL1 (0.44) DPP7DPP4MMP1MMP2MMP8
SCHEMBL3066436 0.76 DPP7 (0.60) DPP7DPP4FAPDPP8DPP9

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-20100267719-A1 Enhanced Indolinone Based Protein Kinase Inhibitors THE SCRIPPS RESEARCH INSTITUTE (US) 2010-10-21 US disclosed
US-20100267719-A1 Enhanced Indolinone Based Protein Kinase Inhibitors THE SCRIPPS RESEARCH INSTITUTE (US) 2010-10-21 US disclosed
EP-1893194-A4 ENHANCED INDOLINONE BASED PROTEIN KINASE INHIBITORS SCRIPPS RESEARCH INST (US) 2009-07-01 EP disclosed
EP-1893194-A1 ENHANCED INDOLINONE BASED PROTEIN KINASE INHIBITORS The Scripps Research Institute (US) 2008-03-05 EP disclosed
US-20060287381-A1 Enhanced indolinone based protein kinase inhibitors THE SCRIPPS RESEARCH INSTITUTE (US) 2006-12-21 US disclosed
WO-2006127961-A1 ENHANCED INDOLINONE BASED PROTEIN KINASE INHIBITORS THE SCRIPPS RESEARCH INSTITUTE (US) 2006-11-30 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 (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-20060287381-A1 Enhanced indolinone based protein kinase inhibitors PHKG1, PHKG2, PRKCH DPP7 2012/4885CPB2 2636/4885DPP4 2943/4885
US-20100267719-A1 Enhanced Indolinone Based Protein Kinase Inhibitors PHKG1, PHKG2, PRKCH DPP7 2387/4885CPB2 4001/4885DPP4 3646/4885

“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.