SCHEMBL9892354

SCHEMBL9892354

CC(=O)N1CCC(CNC(=O)C(C)(C)C)CC1

nearest known ligand 0.54

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 5/20 0.54
EPHX1 P07099 3/20 0.54
CKS1B P61024 2/20 0.43
SKP1 P63208 2/20 0.43
SKP2 Q13309 2/20 0.43
KDM4E B2RXH2 1/20 0.43
PKM P14618 1/20 0.43
PREP P48147 1/20 0.42
FAP Q12884 1/20 0.42
HDAC3 O15379 1/20 0.42
HDAC1 Q13547 1/20 0.42
HDAC2 Q92769 1/20 0.42
ALDH1A1 P00352 1/20 0.41
SIRT2 Q8IXJ6 1/20 0.41
SIRT1 Q96EB6 1/20 0.41
SIRT3 Q9NTG7 1/20 0.41
KCNH2 Q12809 1/20 0.39
CACNA1I Q9P0X4 1/20 0.39
BRD4 O60885 1/20 0.39

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
SCHEMBL22169740 0.90 EPHX2 (0.45) EPHX2EPHX1CKS1BSKP1SKP2
SCHEMBL9893072 0.84 EPHX2 (0.57) EPHX2EPHX1CKS1BSKP1SKP2
SCHEMBL12935918 0.82 CKS1B (0.45) CKS1BSKP1SKP2PREPFAP
SCHEMBL23573524 0.82 EPHX2 (0.56) EPHX2EPHX1KDM4EPKMHDAC3
SCHEMBL12057456 0.81 TDP1 (0.54) EPHX1CKS1BSKP1SKP2PREP
SCHEMBL16039837 0.81 KDM4E (0.51) EPHX2EPHX1CKS1BSKP1SKP2
SCHEMBL24853346 0.81 KDM4E (0.64) EPHX1KDM4EPKM
SCHEMBL4569281 0.81 EPHX2 (0.48) EPHX2EPHX1KDM4EPKMHDAC3
SCHEMBL9893122 0.79 EPHX2 (0.54) EPHX2EPHX1CKS1BSKP1SKP2
SCHEMBL22169803 0.79 EPHX1 (0.54) EPHX2EPHX1CKS1BSKP1SKP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120142677-A1 Pyrrolidine Compounds Which Modulate The CB2 Receptor BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-06-07 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-20120142677-A1 Pyrrolidine Compounds Which Modulate The CB2 Receptor CNR2, CNR1, OPRL1 EPHX2 2014/4885EPHX1 1834/4885CKS1B 1169/4885

“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.