SCHEMBL867019

SCHEMBL867019

CC(C)OC(=O)N1CCC(C(C)Oc2ccc(Br)cc2)CC1

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.52
MEN1 O00255 1/20 0.51
GAA P10253 1/20 0.51
KMT2A Q03164 1/20 0.51
MMP13 P45452 3/20 0.46
MMP1 P03956 2/20 0.45
MMP3 P08254 1/20 0.45
MMP7 P09237 1/20 0.45
MMP9 P14780 1/20 0.45
MMP8 P22894 1/20 0.45
GPR119 Q8TDV5 10/20 0.44
HPGD P15428 1/20 0.41
CHRM2 P08172 1/20 0.41
CHRM1 P11229 1/20 0.41
POLB P06746 1/20 0.40

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
SCHEMBL13160654 0.86 MMP13 (0.46) MMP13MMP1MMP3MMP7MMP9
SCHEMBL865044 0.84 GPR119 (0.56) ALDH1A1GPR119CHRM2
SCHEMBL609865 0.81 GPR119 (0.45) GPR119
SCHEMBL16934608 0.81 GPR119 (0.54) ALDH1A1GAAGPR119
SCHEMBL387351 0.81 GPR119 (0.59) GPR119
SCHEMBL1720752 0.79 GPR119 (0.62) GPR119
SCHEMBL864360 0.78 MMP13 (0.41) MMP13MMP1MMP3MMP7MMP9
SCHEMBL12077313 0.77 ALDH1A1 (0.43) ALDH1A1MEN1GAAKMT2A
SCHEMBL470748 0.76 GPR119 (0.47) GPR119
SCHEMBL470453 0.76 GPR119 (0.47) GPR119

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-20120077793-A1 Compounds for the Treatment of Metabolic Disorders PROSIDION LIMITED (GB) 2012-03-29 US disclosed
US-20120077793-A1 Compounds for the Treatment of Metabolic Disorders PROSIDION LIMITED (GB) 2012-03-29 US disclosed
US-20120077793-A1 Compounds for the Treatment of Metabolic Disorders PROSIDION LIMITED (GB) 2012-03-29 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-20120077793-A1 Compounds for the Treatment of Metabolic Disorders GPR119, GPR132, FFAR2 ALDH1A1 1300/4885MEN1 2335/4885GAA 468/4885

“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.