SCHEMBL10101173

SCHEMBL10101173

CC(C)OC(=O)N1CCC(C(C)Oc2ccc(-c3ccc(C[C@H](NC(=O)OC(C)(C)C)C(=O)N4CCCC4)c(F)c3)cn2)CC1

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.39
DPP4 P27487 1/20 0.38
MAPK1 P28482 1/20 0.38
GPR119 Q8TDV5 6/20 0.37
MC4R P32245 1/20 0.37
PABPC1 P11940 1/20 0.37
ALDH1A1 P00352 1/20 0.36
LMNA P02545 1/20 0.36
POLB P06746 1/20 0.36
MEN1 O00255 1/20 0.36
MMP13 P45452 1/20 0.35
PIK3CD O00329 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
SCHEMBL865412 1.00 KMT2A (0.39) KMT2ADPP4MAPK1GPR119MC4R
SCHEMBL865411 1.00 KMT2A (0.39) KMT2ADPP4MAPK1GPR119MC4R
SCHEMBL864975 0.93 DPP4 (0.37) KMT2ADPP4MAPK1GPR119MC4R
SCHEMBL10101176 0.93 DPP4 (0.37) KMT2ADPP4MAPK1GPR119MC4R
SCHEMBL864976 0.93 DPP4 (0.37) KMT2ADPP4MAPK1GPR119MC4R
SCHEMBL864977 0.93 DPP4 (0.37) KMT2ADPP4MAPK1GPR119MC4R
SCHEMBL864520 0.91 GPR119 (0.42) KMT2ADPP4MAPK1GPR119PABPC1
SCHEMBL864521 0.91 GPR119 (0.42) KMT2ADPP4MAPK1GPR119PABPC1
SCHEMBL10101193 0.89 ALDH1A1 (0.41) KMT2ADPP4MAPK1GPR119MC4R
SCHEMBL865185 0.89 ALDH1A1 (0.41) KMT2ADPP4MAPK1GPR119MC4R

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
WO-2010103333-A1 COMPOUNDS FOR THE TREATMENT OF METABOLIC DISORDERS PROSIDION LIMITED (GB) 2010-09-16 WO 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 KMT2A 2799/4885DPP4 217/4885MAPK1 3641/4885

“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.