SCHEMBL15525637

SCHEMBL15525637

C=CCC1CCC([SeH])(c2ccccc2)C1=O

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.36
LMNA P02545 2/20 0.36
MAPT P10636 1/20 0.36
CES2 O00748 1/20 0.33
HTR1A P08908 1/20 0.32
ADRA1D P25100 1/20 0.32
PNMT P11086 1/20 0.32
MAPK1 P28482 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
MEN1 O00255 1/20 0.31
CYP2C9 P11712 1/20 0.31
KMT2A Q03164 1/20 0.31
OPRM1 P35372 1/20 0.31
OPRD1 P41143 1/20 0.31
OPRK1 P41145 1/20 0.31
EGFR P00533 1/20 0.31

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
SCHEMBL11482499 0.68 MEN1 (0.45) GAALMNAMAPTMAPK1SMN1; SMN2
SCHEMBL2436901 0.64 OPRL1 (0.42) OPRM1OPRK1
SCHEMBL11331123 0.64 FAAH (0.35) GAAMAPK1
SCHEMBL10769617 0.63 OPRL1 (0.45) OPRM1OPRD1OPRK1
SCHEMBL10769619 0.63 OPRL1 (0.45) OPRM1OPRD1OPRK1
SCHEMBL10769625 0.63 OPRL1 (0.45) OPRM1OPRD1OPRK1
SCHEMBL9510310 0.63 GAA (0.31) GAAMAPK1
SCHEMBL14879904 0.62 CYP19A1 (0.40) GAAMAPK1
SCHEMBL23261408 0.61 GAA (0.38) GAALMNAMAPTCES2MAPK1
SCHEMBL11244880 0.60 LMNA (0.35) GAALMNAMAPTMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2852598-B3 RING CONSTRAINED ANALOGS AS ARGINASE INHIBITORS MARS INC (US) 2016-10-19 EP disclosed
EP-2852598-B1 RING CONSTRAINED ANALOGS AS ARGINASE INHIBITORS MARS INC (US) 2016-05-11 EP disclosed
US-9200011-B2 Ring constrained analogs as arginase inhibitors MARS, INCORPORATED (US) 2015-12-01 US disclosed
EP-2852598-A1 RING CONSTRAINED ANALOGS AS ARGINASE INHIBITORS Mars, Incorporated (US) 2015-04-01 EP disclosed
US-20150080341-A1 RING CONSTRAINED ANALOGS AS ARGINASE INHIBITORS MARS, INCORPORATED 2015-03-19 US disclosed
WO-2013158262-A1 RING CONSTRAINED ANALOGS AS ARGINASE INHIBITORS MARS, INCORPORATED (US) 2013-10-24 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-20150080341-A1 RING CONSTRAINED ANALOGS AS ARGINASE INHIBITORS ARG1, ARG2, PADI1 GAA 126/4885LMNA 3660/4885MAPT 3322/4885

“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.