SCHEMBL13699562

SCHEMBL13699562

Cc1cc(Cl)ccc1N1CCN(C(=O)C(C)(C)C)C[C@H]1c1ccc(-c2c(C)ncnc2N)cc1

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MDM2 Q00987 15/20 0.44
MEN1 O00255 1/20 0.36
IDE P14735 1/20 0.36
KMT2A Q03164 1/20 0.36
ADK P55263 2/20 0.36
LMNA P02545 1/20 0.36
MAPK1 P28482 1/20 0.36
CYP3A4 P08684 1/20 0.35
CYP3A5 P20815 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
SCHEMBL13699560 0.84 MDM2 (0.43) MDM2MEN1IDEKMT2A
SCHEMBL4166201 0.81 MDM2 (0.47) MDM2MEN1IDEKMT2ALMNA
SCHEMBL4166206 0.81 MDM2 (0.47) MDM2MEN1IDEKMT2ALMNA
SCHEMBL13699561 0.81 MDM2 (0.45) MDM2MEN1IDEKMT2ACYP3A4
SCHEMBL4163914 0.79 MDM2 (0.46) MDM2MEN1IDEKMT2ALMNA
SCHEMBL4168355 0.78 MDM2 (0.43) MDM2MEN1IDEKMT2ALMNA
SCHEMBL4168350 0.78 MDM2 (0.43) MDM2MEN1IDEKMT2ALMNA
SCHEMBL13699629 0.77 MDM2 (0.40) MDM2MEN1IDEKMT2ALMNA
SCHEMBL13699573 0.77 MDM2 (0.44) MDM2MEN1IDEKMT2ALMNA
SCHEMBL13699559 0.77 CNR1 (0.42) MDM2MEN1IDEKMT2ALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090221582-A1 Piperazine Derivatives And Their Use In Therapy VERNALIS (R&D) (GB) 2009-09-03 US disclosed
US-20090221582-A1 Piperazine Derivatives And Their Use In Therapy VERNALIS (R&D) (GB) 2009-09-03 US disclosed
WO-2007057687-A1 PIPERAZINE DERIVATIVES AND THEIR USE IN THERAPY VERNALIS (R & D) LIMITED (GB) 2007-05-24 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-20090221582-A1 Piperazine Derivatives And Their Use In Therapy CNR2, CNR1, ALK MDM2 2997/4885MEN1 1455/4885IDE 4572/4885

“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.