SCHEMBL1446592

SCHEMBL1446592

COCCOC1(C(=O)O)CCN(C(=O)OC(C)(C)C)CC1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
OPRD1 P41143 1/20 0.39
OPRK1 P41145 1/20 0.39
KDM4E B2RXH2 1/20 0.38
PKM P14618 1/20 0.38
DDB1 Q16531 1/20 0.38
CRBN Q96SW2 1/20 0.38
HPGD P15428 1/20 0.38
ALOX15 P16050 1/20 0.37
TSHR P16473 1/20 0.37
ATM Q13315 1/20 0.37
EPHX2 P34913 1/20 0.37
GPR119 Q8TDV5 3/20 0.37
TACR1 P25103 1/20 0.37
POLB P06746 1/20 0.37

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
SCHEMBL4302097 0.87 USP2 (0.42) USP2SMN1; SMN2KDM4EPKMDDB1
SCHEMBL5751491 0.87 USP2 (0.44) USP2SMN1; SMN2OPRD1OPRK1DDB1
SCHEMBL22511255 0.86 USP2 (0.43) USP2SMN1; SMN2OPRD1OPRK1DDB1
SCHEMBL25363246 0.84 USP2 (0.46) USP2SMN1; SMN2OPRD1OPRK1DDB1
SCHEMBL1146902 0.82 USP2 (0.50) USP2SMN1; SMN2HPGDALOX15TSHR
SCHEMBL31382632 0.80 TACR1 (0.44) USP2SMN1; SMN2OPRD1OPRK1DDB1
SCHEMBL29215638 0.80 USP2 (0.43) USP2SMN1; SMN2KDM4EPKMHPGD
SCHEMBL1446876 0.78 LMNA (0.50) SMN1; SMN2OPRD1OPRK1POLB
SCHEMBL17146104 0.78 USP2 (0.46) USP2SMN1; SMN2HPGDALOX15TSHR
SCHEMBL2279208 0.78 USP2 (0.46) USP2SMN1; SMN2HPGDALOX15TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2297153-B1 LIMK2 INHIBITORS, COMPOSITIONS COMPRISING THEM, AND METHODS OF THEIR USE LEXICON PHARMACEUTICALS INC (US) 2015-05-27 EP disclosed
CN-101565420-B Limk2 inhibitors, compositions comprising them, and methods of their use LEXICON PHARMACEUTICALS INC 2015-05-20 CN disclosed
EP-2674433-A1 LIMK2 inhibitors, compositions comprising them and methods of their use Lexicon Pharmaceuticals, Inc. (US) 2013-12-18 EP disclosed
US-8450332-B2 LIMK2 inhibitors, compositions comprising them, and methods of their use LEXICON PHARMACEUTICALS, INC. (US) 2013-05-28 US disclosed
US-20120329818-A1 LIMK2 INHIBITORS, COMPOSITIONS COMPRISING THEM, AND METHODS OF THEIR USE OXFORD FINANCE LLC, AS COLLATERAL AGENT 2012-12-27 US disclosed
US-8193202-B2 LIMK2 inhibitors, compositions comprising them, and methods of their use LEXICON PHARMACEUTICALS, INC. (US) 2012-06-05 US disclosed
EP-2297153-A1 LIMK2 INHIBITORS, COMPOSITIONS COMPRISING THEM, AND METHODS OF THEIR USE Lexicon Pharmaceuticals, Inc. (US) 2011-03-23 EP disclosed
WO-2009131940-A1 LIMK2 INHIBITORS, COMPOSITIONS COMPRISING THEM, AND METHODS OF THEIR USE LEXICON PHARMACEUTICALS, INC. (US) 2009-10-29 WO disclosed
CN-101565420-A LIMK2 inhibitors, compositions comprising them, and methods of their use LEXICON PHARMACEUTICALS INC (US) 2009-10-28 CN disclosed
US-20090264450-A1 LIMK2 INHIBITORS, COMPOSITIONS COMPRISING THEM, AND METHODS OF THEIR USE OXFORD FINANCE LLC, AS COLLATERAL AGENT 2009-10-22 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-20120329818-A1 LIMK2 INHIBITORS, COMPOSITIONS COMPRISING THEM, AND METHODS OF THEIR USE LIMK2, LIMK1, LIMA1 USP2 1948/4885SMN1; SMN2 1340/4885OPRD1 3786/4885
US-20090264450-A1 LIMK2 INHIBITORS, COMPOSITIONS COMPRISING THEM, AND METHODS OF THEIR USE LIMK2, LIMK1, LIMA1 USP2 1948/4885SMN1; SMN2 1340/4885OPRD1 3786/4885

“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.