SCHEMBL12316699

SCHEMBL12316699

Nc1cc(Cl)cc2c1OCCC2=O

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.42
MAPT P10636 1/20 0.42
MAOB P27338 3/20 0.37
KMT2A Q03164 2/20 0.37
VHL P40337 1/20 0.37
ELOC Q15369 1/20 0.37
ELOB Q15370 1/20 0.37
MEN1 O00255 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
MAOA P21397 1/20 0.37
GRM5 P41594 2/20 0.34
CYP3A4 P08684 1/20 0.33
SIRT2 Q8IXJ6 4/20 0.32
CASP1 P29466 1/20 0.30
CASP7 P55210 1/20 0.30
HSD17B10 Q99714 1/20 0.30

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
SCHEMBL30543406 0.82 MEN1 (0.46) LMNAMAPTMAOBKMT2AVHL
SCHEMBL67615 0.82 MEN1 (0.46) LMNAMAPTMAOBKMT2AVHL
SCHEMBL6582453 0.79 SIRT2 (0.38) LMNAMAPTMAOBKMT2AVHL
SCHEMBL14053377 0.79 NOTUM (0.42) LMNAMAPTMAOBKMT2AVHL
SCHEMBL12316580 0.79 SIRT2 (0.47) LMNAMAPTMAOBKMT2AVHL
SCHEMBL12316586 0.79 LMNA (0.42) LMNAMAPTMAOBMAOAGRM5
SCHEMBL12316746 0.79 MAOB (0.44) LMNAMAPTMAOBKMT2AVHL
SCHEMBL8191575 0.79 MAOB (0.37) LMNAMAPTMAOBKMT2AVHL
SCHEMBL12316691 0.76 LMNA (0.49) LMNAMAPTMAOBVHLELOC
SCHEMBL4107808 0.74 PARP1 (0.39) LMNAMAPTCYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8263592-B2 Equilibrative nucleoside transporter ENT1 inhibitors JANSSEN PHARMACEUTICA NV (BE) 2012-09-11 US disclosed
US-8263592-B2 Equilibrative nucleoside transporter ENT1 inhibitors JANSSEN PHARMACEUTICA NV (BE) 2012-09-11 US disclosed
US-20100280025-A1 EQUILIBRATIVE NUCLEOSIDE TRANSPORTER ENT1 INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2010-11-04 US disclosed
US-20100280025-A1 EQUILIBRATIVE NUCLEOSIDE TRANSPORTER ENT1 INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2010-11-04 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-20100280025-A1 EQUILIBRATIVE NUCLEOSIDE TRANSPORTER ENT1 INHIBITORS SLC29A1, SLC29A2, SLC43A3 LMNA 2514/4885MAPT 2089/4885MAOB 1632/4885

“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.