SCHEMBL1509675

SCHEMBL1509675

CN(C)CCOc1ncccc1-c1ccc(O)c(-c2nc3cc(C(=O)NCCc4cnc[nH]4)c(F)cc3[nH]2)c1

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.40
MEN1 O00255 1/20 0.40
PBK Q96KB5 2/20 0.39
NAMPT P43490 5/20 0.37
RAD52 P43351 1/20 0.37
UHRF1 Q96T88 1/20 0.37
F10 P00742 2/20 0.35
PLG P00747 2/20 0.35
PLAU P00749 2/20 0.35
GPR52 Q9Y2T5 1/20 0.35
KIT P10721 1/20 0.35
HRH4 Q9H3N8 1/20 0.35
HRH3 Q9Y5N1 1/20 0.35
F2 P00734 1/20 0.34
PLAT P00750 1/20 0.34
MC2R Q01718 1/20 0.34
MET P08581 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
SCHEMBL1509562 0.93 KMT2A (0.45) KMT2AMEN1PBKNAMPTF10
SCHEMBL14091684 0.92 PBK (0.40) KMT2AMEN1PBKNAMPTF10
SCHEMBL12834094 0.83 MC2R (0.36) NAMPTRAD52UHRF1F10PLG
SCHEMBL1509555 0.83 PLG (0.42) F10PLGPLAUKITF2
SCHEMBL14091687 0.83 PLG (0.43) F10PLGPLAUF2PLAT
Hydrochloric Acid SCHEMBL1509637 0.82 F10 (0.42) F10PLGPLAUF2PLAT
SCHEMBL1509477 0.79 F10 (0.38) NAMPTF10PLGPLAUF2
SCHEMBL1509505 0.76 NAMPT (0.36) NAMPTF10PLGPLAUF2
SCHEMBL12834421 0.75 CARM1 (0.36) NAMPTF10PLGPLAUF2
SCHEMBL4754559 0.74 PLG (0.51) F10PLGPLAUF2PLAT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8629147-B2 Heterocyclic compounds useful in the treatment of neoplastic diseases, inflammatory disorders and immunomodulatory disorders CHEMBRIDGE CORPORATION (US) 2014-01-14 US disclosed
US-8629147-B2 Heterocyclic compounds useful in the treatment of neoplastic diseases, inflammatory disorders and immunomodulatory disorders CHEMBRIDGE CORPORATION (US) 2014-01-14 US disclosed
EP-2298770-A1 Heterocyclic compounds as TrkA modulators ChemBridge Corporation (US) 2011-03-23 EP disclosed
US-20080207635-A1 Heterocyclic compounds useful in the treatment of neoplastic diseases, inflammatory disorders and immunomodulatory disorders CHEMBRIDGE CORPORATION 2008-08-28 US disclosed
WO-2007056155-A1 HETEROCYCLIC COMPOUNDS AS TYROSINE KINASE MODULATORS CHEMBRIDGE RESEARCH LABORATORIES, INC. (US) 2007-05-18 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 (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-20080207635-A1 Heterocyclic compounds useful in the treatment of neoplastic diseases, inflammatory disorders and immunomodulatory disorders LCK, MALT1, MYD88 KMT2A 1726/4885MEN1 1879/4885PBK 104/4885

“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.