SCHEMBL3960804

SCHEMBL3960804

CCOC(=O)[C@H](Cc1ccc(OCC(=O)N(Cc2ccc(Cl)cc2)Cc2ccc(C(C)(C)C)cc2)cc1)OCC

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
RAB9A P51151 1/20 0.46
MAPT P10636 4/20 0.45
TP53 P04637 4/20 0.45
PPARA Q07869 3/20 0.44
PPARG P37231 1/20 0.44
TRPM8 Q7Z2W7 2/20 0.42
THRB P10828 1/20 0.41
MCHR1 Q99705 1/20 0.40
POLB P06746 1/20 0.40
ALDH1A1 P00352 1/20 0.40
LMNA P02545 1/20 0.40

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
SCHEMBL3960802 0.93 MAPT (0.49) MAPTTP53PPARAPPARGTRPM8
SCHEMBL3965746 0.91 PPARA (0.50) MAPTTP53PPARAPPARGTRPM8
SCHEMBL3968349 0.91 PPARA (0.53) MEN1KMT2ARAB9APPARAPPARG
SCHEMBL3964675 0.91 TRPM8 (0.52) MEN1KMT2ARAB9AMAPTTP53
SCHEMBL3963635 0.89 TRPM8 (0.54) MAPTTP53PPARATRPM8POLB
SCHEMBL3956888 0.88 TP53 (0.53) RAB9AMAPTTP53PPARATRPM8
SCHEMBL3963785 0.86 TRPM8 (0.49) MAPTTP53PPARAPPARGTRPM8
SCHEMBL3963868 0.84 PPARA (0.54) MEN1KMT2ARAB9AMAPTTP53
SCHEMBL3969064 0.84 PPARA (0.60) PPARAPPARG
SCHEMBL3966524 0.83 PPARA (0.59) PPARAPPARGTRPM8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7488844-B2 Therapeutic agents ASTRAZENECA AB (SE) 2009-02-10 US disclosed
US-20050282822-A1 Therapeutic agents ASTRAZENECA AB (SE) 2005-12-22 US 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-20050282822-A1 Therapeutic agents GPR119, LIPC, PNLIP MEN1 2350/4885KMT2A 4622/4885RAB9A 1893/4885

“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.