SCHEMBL4425930

SCHEMBL4425930

Cc1cc(N2CCNCC2C(=O)OC(C)(C)C)ccc1C(=O)Nc1ccc2cccnc2c1

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
NOTUM Q6P988 1/20 0.39
TRPV1 Q8NER1 4/20 0.38
P2RY14 Q15391 2/20 0.37
CHRNA7 P36544 2/20 0.36
NPC1 O15118 3/20 0.36
RAB9A P51151 3/20 0.36
POLB P06746 1/20 0.36
DHODH Q02127 1/20 0.36
THRB P10828 1/20 0.35
MAPT P10636 1/20 0.35
RXFP1 Q9HBX9 1/20 0.35
CRHBP P24387 1/20 0.35
CRHR2 Q13324 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
SCHEMBL4425924 0.78 MEN1 (0.52) MEN1KMT2ANOTUMPOLBTHRB
SCHEMBL4429861 0.77 RAD52 (0.36) MEN1KMT2A
SCHEMBL8468999 0.72 MEN1 (0.43) MEN1KMT2ANPC1RAB9APOLB
SCHEMBL5637366 0.69 KDM4E (0.46)
SCHEMBL4143683 0.69 HTR1A (0.41) POLBMAPT
SCHEMBL27561229 0.68 SLC6A2 (0.44)
SCHEMBL5864038 0.68 MAPT (0.38) NPC1RAB9ADHODHTHRBMAPT
SCHEMBL2298747 0.68 HTR2A (0.41) POLB
SCHEMBL4144010 0.68 HTR1A (0.45) KMT2A
SCHEMBL4427488 0.67 TRPV1 (0.61) MEN1KMT2ANOTUMTRPV1P2RY14

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-7538121-B2 Vanilloid receptor modulators GLAXO GROUP LIMITED (GB) 2009-05-26 US disclosed
EP-2033953-A1 Vanilloid receptor modulators Glaxo Group Limited (GB) 2009-03-11 EP disclosed
US-20060142333-A1 Vanilloid receptor modulators MACDONALD GREGOR J 2006-06-29 US disclosed
EP-1480954-A1 VANILLOID RECEPTOR MODULATORS GLAXO GROUP LIMITED (GB) 2004-12-01 EP disclosed
WO-2003068749-A1 VANILLOID RECEPTOR MODULATORS GLAXO GROUP LIMITED (GB) 2003-08-21 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-20060142333-A1 Vanilloid receptor modulators TRPV1, NPSR1, TRPV3 MEN1 3527/4885KMT2A 3992/4885NOTUM 3472/4885

“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.