SCHEMBL6781296

SCHEMBL6781296

COc1ccc(N(Cc2ccccc2-c2ccccc2)C(=O)c2ccccc2OC)cn1

nearest known ligand 0.51

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ OXTR P30559 15/20 0.51
▸ AVPR1A P37288 4/20 0.45
▸ MAPKAPK2 P49137 1/20 0.43
▸ LPAR1 Q92633 1/20 0.43
▸ PDK1 Q15118 1/20 0.42
▸ AVPR2 P30518 2/20 0.42
▸ BRS3 P32247 1/20 0.41
▸ MEN1 O00255 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ KMT2A Q03164 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
SCHEMBL6780224 0.93 OXTR (0.51) OXTRAVPR1AMAPKAPK2AVPR2MEN1
SCHEMBL6777578 0.85 ALDH1A1 (0.54) OXTRAVPR1AMAPKAPK2AVPR2ALDH1A1
SCHEMBL6778658 0.84 OXTR (0.46) OXTRAVPR1AMAPKAPK2AVPR2
SCHEMBL6775891 0.83 PDK1 (0.47) LPAR1PDK1MEN1ALDH1A1MAPT
SCHEMBL6773967 0.81 OXTR (0.53) OXTRAVPR1AMAPKAPK2AVPR2MAPT
SCHEMBL6778305 0.78 LTB4R2 (0.52) LPAR1MEN1ALDH1A1MAPTKMT2A
SCHEMBL6780398 0.78 LMNA (0.51) LPAR1PDK1ALDH1A1
SCHEMBL6781088 0.77 ALDH1A1 (0.45) PDK1ALDH1A1MAPT
SCHEMBL6781046 0.76 MEN1 (0.49) PDK1MEN1ALDH1A1KMT2A
SCHEMBL6778429 0.75 MAPT (0.50) PDK1ALDH1A1MAPT

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-20020156281-A1 Amide inhibitors of microsomal triglyceride transfer protein BOOTH RICHARD JOHN (US) 2002-10-24 — — US claimed
US-6780883-B2 ANTICHOLESTEROL AGENTS; CARDIOVASCULAR DISORDERS; ANTILIPEMIC AGENTS; RESTENOSIS; DIETETICS WARNER-LAMBERT COMPANY 2004-08-24 — — US disclosed
US-20020156281-A1 Amide inhibitors of microsomal triglyceride transfer protein BOOTH RICHARD JOHN (US) 2002-10-24 — — 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-20020156281-A1 Amide inhibitors of microsomal triglyceride transfer protein CETP, MTTP, LCAT OXTR 2739/4885AVPR1A 4552/4885MAPKAPK2 2572/4885

“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.

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