SCHEMBL13312002

SCHEMBL13312002

CC(C)(C)OC(=O)N1CCCc2c(C=O)cccc21

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
UCHL1 P09936 5/20 0.45
KDM1A O60341 1/20 0.42
HDAC1 Q13547 2/20 0.42
HDAC6 Q9UBN7 2/20 0.42
NOTUM Q6P988 3/20 0.39
BACE1 P56817 1/20 0.37
BCHE P06276 1/20 0.37
BRD4 O60885 1/20 0.37
GPR119 Q8TDV5 1/20 0.36
MPO P05164 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
TSHR P16473 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
SCN5A Q14524 1/20 0.35
SCN9A Q15858 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
SCHEMBL15646819 0.92 UCHL1 (0.49) UCHL1KDM1AHDAC1HDAC6NOTUM
SCHEMBL30147617 0.83 UCHL1 (0.61) UCHL1KDM1AHDAC1HDAC6NOTUM
SCHEMBL20571008 0.83 UCHL1 (0.61) UCHL1KDM1AHDAC1HDAC6NOTUM
SCHEMBL2885604 0.83 UCHL1 (0.47) UCHL1KDM1AHDAC1HDAC6NOTUM
SCHEMBL20571049 0.81 UCHL1 (0.46) UCHL1KDM1AHDAC1HDAC6NOTUM
SCHEMBL26100463 0.81 UCHL1 (0.48) UCHL1KDM1AHDAC1HDAC6NOTUM
SCHEMBL3133623 0.80 L3MBTL1 (0.39) UCHL1KDM1ANOTUMBRD4MPO
SCHEMBL2885921 0.80 NOTUM (0.47) UCHL1KDM1AHDAC1HDAC6NOTUM
SCHEMBL3502782 0.80 UCHL1 (0.45) UCHL1KDM1AHDAC1HDAC6NOTUM
SCHEMBL22048927 0.79 HDAC1 (0.51) UCHL1KDM1AHDAC1HDAC6NOTUM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100152165-A1 CARBOXYLIC ACID DERIVATIVES ASTELLAS PHARMA INC. (JP) 2010-06-17 US disclosed
US-20100152165-A1 CARBOXYLIC ACID DERIVATIVES ASTELLAS PHARMA INC. (JP) 2010-06-17 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-20100152165-A1 CARBOXYLIC ACID DERIVATIVES GPR119, GPR65, HCAR1 UCHL1 2478/4885KDM1A 3273/4885HDAC1 952/4885

“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.