SCHEMBL252109

SCHEMBL252109

CCOC(=O)c1cn2nc(Cn3nnc4ccc(Br)cc43)ccc2n1

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 8/20 0.46
RAB9A P51151 4/20 0.46
NPC1 O15118 3/20 0.46
RXFP1 Q9HBX9 1/20 0.46
KMT2A Q03164 2/20 0.46
L3MBTL1 Q9Y468 1/20 0.43
ALDH1A1 P00352 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
POLB P06746 1/20 0.39
CYP19A1 P11511 3/20 0.38
MAPT P10636 2/20 0.38
ATM Q13315 1/20 0.38
GAA P10253 1/20 0.38
GABRA2 P47869 1/20 0.36
GABRB2 P47870 1/20 0.36
GABRG2 P18507 1/20 0.36
GABRB3 P28472 1/20 0.36
GABRA5 P31644 1/20 0.36

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
SCHEMBL252919 0.86 MGAM (0.34) KDM4ERAB9ANPC1GAA
SCHEMBL13455804 0.81 MGAM (0.31) RAB9AGAA
SCHEMBL252382 0.80 CSNK1D (0.36) RAB9AGAA
SCHEMBL3397770 0.79 RAB9A (0.36) KDM4ERAB9ANPC1RXFP1KMT2A
SCHEMBL253221 0.78 PIK3CG (0.36) GAA
Hydrochloric Acid SCHEMBL251752 0.77 PIK3CG (0.35)
SCHEMBL1550773 0.75 KDR (0.43)
SCHEMBL31035800 0.75 KDM4E (0.64) KDM4ERAB9ANPC1RXFP1KMT2A
SCHEMBL253191 0.75 MGAM (0.31) RAB9AGAA
SCHEMBL14417633 0.73 KDM4E (0.61) KDM4ERAB9ANPC1RXFP1KMT2A

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
EP-2313407-B1 cMET INHIBITORS TAKEDA PHARMACEUTICAL (JP) 2016-10-05 EP disclosed
US-20130315895-A1 COMBINATION OF A cMET INHIBITOR AND AN ANTIBODY TO HGF AND/OR cMET TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2013-11-28 US disclosed
EP-2588107-A1 COMBINATION OF A cMET INHIBITOR AND AN ANTIBODY TO HGF AND/OR cMET Takeda Pharmaceutical Company Limited (JP) 2013-05-08 EP disclosed
US-8178534-B2 cMET inhibitors TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-05-15 US disclosed
WO-2012003338-A1 COMBINATION OF A cMET INHIBITOR AND AN ANTIBODY TO HGF AND/OR cMET TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-01-05 WO disclosed
EP-2313407-A1 cMET INHIBITORS Takeda Pharmaceutical Company Limited (JP) 2011-04-27 EP disclosed
US-20100063054-A1 cMET INHIBITORS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-03-11 US disclosed
WO-2010019899-A1 cMET INHIBITORS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-02-18 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-20130315895-A1 COMBINATION OF A cMET INHIBITOR AND AN ANTIBODY TO HGF AND/OR cMET HGF, MET, HGFAC KDM4E 2451/4885RAB9A 2119/4885NPC1 1589/4885
US-20100063054-A1 cMET INHIBITORS CEPT1, LCAT, GNMT KDM4E 664/4885RAB9A 2752/4885NPC1 313/4885

“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.