SCHEMBL2837010

SCHEMBL2837010

CCOC(=O)N1CCc2oc(C)cc2C(=O)C1

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
PABPC1 P11940 1/20 0.40
ATM Q13315 1/20 0.40
KMT2A Q03164 2/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
TDP1 Q9NUW8 1/20 0.38
TSHR P16473 1/20 0.38
KDM4E B2RXH2 3/20 0.38
RXFP1 Q9HBX9 2/20 0.38
ALDH1A1 P00352 5/20 0.37
POLB P06746 1/20 0.37
GAA P10253 1/20 0.36
MEN1 O00255 1/20 0.36

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
SCHEMBL2840772 0.90 LMNA (0.40) LMNASMN1; SMN2PABPC1ATMKMT2A
SCHEMBL985894 0.72 NOS3 (0.44) LMNASMN1; SMN2PABPC1ATMKMT2A
SCHEMBL2835727 0.71 L3MBTL1 (0.42) LMNASMN1; SMN2PABPC1ATMKMT2A
SCHEMBL2835764 0.70 GAA (0.40) LMNASMN1; SMN2ATMKMT2AL3MBTL1
SCHEMBL568818 0.70 TSHR (0.47) LMNASMN1; SMN2PABPC1ATMKMT2A
SCHEMBL11072823 0.69 TSHR (0.55) LMNASMN1; SMN2KMT2AL3MBTL1TDP1
SCHEMBL11071015 0.69 ALDH1A1 (0.45) LMNASMN1; SMN2PABPC1ATMKMT2A
SCHEMBL8187218 0.69 MEN1 (0.41) LMNASMN1; SMN2PABPC1ATMKMT2A
SCHEMBL2840999 0.69 KMT2A (0.43) LMNASMN1; SMN2KMT2AL3MBTL1TDP1
SCHEMBL21767046 0.69 LMNA (0.43) LMNASMN1; SMN2PABPC1ATMKMT2A

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-8217031-B2 Heteroaryl derivatives NIPPON SHINYAKU CO., LTD. (JP) 2012-07-10 US disclosed
US-20100048537-A1 HETEROARYL DERIVATIVES NIPPON SHINYAKU CO., LTD. (JP) 2010-02-25 US disclosed
EP-2141168-A1 HETEROARYL DERIVATIVES Nippon Shinyaku Co., Ltd. (JP) 2010-01-06 EP 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-20100048537-A1 HETEROARYL DERIVATIVES OPRD1, OPRM1, OPRK1 LMNA 4746/4885SMN1; SMN2 723/4885PABPC1 4196/4885

“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.