SCHEMBL2894589

SCHEMBL2894589

CC(C)(C)OC(=O)N1CCCC1(O)C(=O)O.c1ccc2c(c1)C2

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.40
GPR119 Q8TDV5 1/20 0.38
USP30 Q70CQ3 1/20 0.38
KDM1A O60341 3/20 0.37
NAMPT P43490 2/20 0.37
GRIN2B Q13224 1/20 0.37
GRIN2C Q14957 1/20 0.37
TSHR P16473 2/20 0.36
ALOX15 P16050 1/20 0.36
ATM Q13315 1/20 0.36
JAK3 P52333 1/20 0.36
NR1H2 P55055 1/20 0.36
NR1H3 Q13133 1/20 0.36
KDM4E B2RXH2 1/20 0.35
PKM P14618 1/20 0.35

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
SCHEMBL2774828 0.87 GRIN2B (0.41) GPR119USP30GRIN2BGRIN2CJAK3
SCHEMBL199926 0.87 GRIN2B (0.41) GPR119USP30GRIN2BGRIN2CJAK3
SCHEMBL1268184 0.87 GRIN2B (0.41) GPR119USP30GRIN2BGRIN2CJAK3
SCHEMBL4002726 0.80 GRIN2B (0.38) GPR119NAMPTGRIN2BGRIN2CJAK3
SCHEMBL15664940 0.78 TSHR (0.43) MAPK1GPR119KDM1AGRIN2BGRIN2C
SCHEMBL27952441 0.78 TSHR (0.43) MAPK1GPR119KDM1AGRIN2BGRIN2C
SCHEMBL27952440 0.78 TSHR (0.43) MAPK1GPR119KDM1AGRIN2BGRIN2C
SCHEMBL3370511 0.78 GRIN2B (0.41) USP30GRIN2BGRIN2CJAK3
SCHEMBL2429525 0.78 GRIN2B (0.41) USP30GRIN2BGRIN2CJAK3
SCHEMBL2894585 0.77

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-7807678-B2 Peptidomimetics of biologically active metallopeptides PALATIN TECHNOLOGIES, INC. (US) 2010-10-05 US disclosed
US-7326707-B2 Bicyclic melanocortin-specific compounds PALATIN TECHNOLOGIES INCORPORATED (US) 2008-02-05 US disclosed
US-20040171520-A1 Peptidomimetics of biologically active metallopeptides PALATIN TECHNOLOGIES, INC. 2004-09-02 US disclosed
US-20040152134-A1 Bicyclic melanocortin-specific compounds PALATIN TECHNOLOGIES, INC. (US) 2004-08-05 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 (2 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-20040171520-A1 Peptidomimetics of biologically active metallopeptides MC1R, MC4R, MC5R MAPK1 3194/4885GPR119 493/4885USP30 4199/4885
US-20040152134-A1 Bicyclic melanocortin-specific compounds MC3R, MC5R, MC2R MAPK1 2316/4885GPR119 71/4885USP30 4649/4885

“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.