SCHEMBL6182275

SCHEMBL6182275

CCCCC1(C(=O)OCC)CCN(OC(=O)C(F)(F)F)CC1

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.42
LMNA P02545 3/20 0.42
POLB P06746 2/20 0.42
PKM P14618 2/20 0.42
KMT2A Q03164 8/20 0.40
MEN1 O00255 7/20 0.40
NPY1R P25929 1/20 0.40
ALDH1A1 P00352 8/20 0.39
MAPK1 P28482 2/20 0.39
L3MBTL1 Q9Y468 1/20 0.38
KDM4E B2RXH2 2/20 0.36
OPRM1 P35372 1/20 0.36
OPRD1 P41143 1/20 0.36

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
SCHEMBL1309430 0.87 GAA (0.38) MAPTLMNAPOLBPKMKMT2A
SCHEMBL6134918 0.77 CES2 (0.33)
SCHEMBL7443750 0.75 CYP4F2 (0.45) MAPTLMNAPOLBPKMKMT2A
SCHEMBL27987602 0.74 LMNA (0.38) MAPTLMNAPOLBPKMKMT2A
SCHEMBL8071102 0.74 CYP4F2 (0.45) MAPTLMNAPOLBPKMKMT2A
SCHEMBL11345271 0.74 CYP4F2 (0.49) MAPTLMNAPOLBPKMKMT2A
Trifluoroacetic Acid SCHEMBL6182271 0.74 OPRM1 (0.43) MAPTLMNAPOLBPKMKMT2A
SCHEMBL7557203 0.73 CYP3A4 (0.44) MAPTLMNAPOLBKMT2AMEN1
SCHEMBL1308813 0.73 CYP3A4 (0.44) MAPTLMNAPOLBKMT2AMEN1
SCHEMBL21399965 0.73 CYP4F2 (0.47) MAPTLMNAPOLBPKMKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1187614-A4 SUBSTITUTED PIPERIDINES AS MELANOCORTIN-4 RECEPTOR AGONISTS MERCK & CO INC (US) 2005-06-22 EP disclosed
US-20020137664-A1 Substituted piperidines as melanocortin-4 receptor agonists MERCK & CO., INC. 2002-09-26 US disclosed
EP-1187614-A1 SUBSTITUTED PIPERIDINES AS MELANOCORTIN-4 RECEPTOR AGONISTS Merck & Co., Inc. (US) 2002-03-20 EP disclosed
US-6350760-B1 OBESITY, DIABETES, SEXUAL DYSFUNCTION; MERCK & CO., INC. 2002-02-26 US disclosed
WO-2000074679-A1 SUBSTITUTED PIPERIDINES AS MELANOCORTIN-4 RECEPTOR AGONISTS MERCK & CO., INC. (US) 2000-12-14 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-20020137664-A1 Substituted piperidines as melanocortin-4 receptor agonists MC4R, MC5R, MC3R MAPT 3276/4885LMNA 4606/4885POLB 2998/4885

“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.