SCHEMBL963488

SCHEMBL963488

CC/C(=C\c1c(C)nn(C)c1-n1ccc2ccc(OCCOC)cc21)C(=O)O

nearest known ligand 0.38

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MET P08581 1/20 0.38
MCL1 Q07820 10/20 0.37
BRD4 O60885 7/20 0.34
NR3C1 P04150 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
SCHEMBL963489 1.00 MET (0.38) METMCL1BRD4NR3C1
SCHEMBL966845 0.91 MAPT (0.38) MCL1
SCHEMBL966843 0.91 MAPT (0.38) MCL1
SCHEMBL963543 0.90 MTNR1A (0.41) MCL1
SCHEMBL963542 0.90 MTNR1A (0.41) MCL1
SCHEMBL961609 0.89 MCL1 (0.37) MCL1
SCHEMBL961611 0.89 MCL1 (0.37) MCL1
SCHEMBL966603 0.88 ABL1 (0.37) MCL1
SCHEMBL966600 0.88 ABL1 (0.37) MCL1
SCHEMBL966158 0.87 SRD5A2 (0.41) MCL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110009384-A1 FUSED RING COMPOUNDS AS PARTIAL AGONISTS OF PPAR-GAMMA TAKEDA PHARMACEUTICAL COMPANY LIMITED 2011-01-13 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-20110009384-A1 FUSED RING COMPOUNDS AS PARTIAL AGONISTS OF PPAR-GAMMA PPARA, PPARD, PPARG MET 371/4885MCL1 3693/4885BRD4 193/4885

“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.