SCHEMBL2587322

SCHEMBL2587322

CCC(CC(=O)c1ccccc1)c1ccc(Cl)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.57
ATM Q13315 1/20 0.54
POLB P06746 3/20 0.52
CYP2C9 P11712 3/20 0.52
CYP2C19 P33261 2/20 0.52
MGAM O43451 1/20 0.50
GAA P10253 1/20 0.50
SI P14410 1/20 0.50
MGAM2 Q2M2H8 1/20 0.50
PDPK1 O15530 1/20 0.49
KMT2A Q03164 4/20 0.48
MEN1 O00255 3/20 0.48
HTT P42858 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48
GABBR2 O75899 3/20 0.47
GABBR1 Q9UBS5 3/20 0.47
LMNA P02545 2/20 0.47
TSHR P16473 2/20 0.47
CYP3A4 P08684 1/20 0.47
ADORA3 P0DMS8 1/20 0.47

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
SCHEMBL12158732 1.00 L3MBTL1 (0.57) L3MBTL1ATMPOLBCYP2C9CYP2C19
SCHEMBL28731474 0.90 L3MBTL1 (0.64) L3MBTL1ATMPOLBCYP2C9CYP2C19
SCHEMBL12158645 0.89 ATM (0.66) L3MBTL1ATMPOLBCYP2C9CYP2C19
SCHEMBL28114650 0.89 ATM (0.66) L3MBTL1ATMPOLBCYP2C9CYP2C19
SCHEMBL2581702 0.89 ATM (0.66) L3MBTL1ATMPOLBCYP2C9CYP2C19
SCHEMBL28010708 0.86 L3MBTL1 (0.59) L3MBTL1ATMPOLBMGAMGAA
SCHEMBL2579321 0.86 L3MBTL1 (0.59) L3MBTL1ATMPOLBMGAMGAA
SCHEMBL12158725 0.86 L3MBTL1 (0.59) L3MBTL1ATMPOLBMGAMGAA
SCHEMBL12158733 0.84 L3MBTL1 (0.57) L3MBTL1ATMPOLBMGAMGAA
SCHEMBL2584297 0.84 L3MBTL1 (0.57) L3MBTL1ATMPOLBMGAMGAA

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-8304581-B2 Method of enantioselective addition to enones NATIONAL TSING HUA UNIVERSITY (TW) 2012-11-06 US disclosed
US-20110282101-A1 METHOD OF ENANTIOSELECTIVE ADDITION TO ENONES NATIONAL TSING HUA UNIVERSITY (TW) 2011-11-17 US disclosed
US-6380392-B1 COMPLEXES THE PENN STATE RESEARCH FOUNDATION 2002-04-30 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-20110282101-A1 METHOD OF ENANTIOSELECTIVE ADDITION TO ENONES CPNE4, ENY2, CYP3A4 L3MBTL1 3225/4885ATM 4196/4885POLB 1520/4885

“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.