SCHEMBL6760315

SCHEMBL6760315

NCCN(C(=O)O)N(C(=O)c1ccccc1-c1ccc(C(F)(F)F)cc1)C1CCN(CCCCC2(C(=O)NCC(F)(F)F)c3ccccc3-c3ccccc32)CC1

nearest known ligand 0.68

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ MTTP P55157 14/20 0.68
▸ CHRM2 P08172 1/20 0.68
▸ ADRA2A P08913 1/20 0.68
▸ ADORA3 P0DMS8 1/20 0.68
▸ CHRM1 P11229 1/20 0.68
▸ DRD1 P21728 1/20 0.68
▸ TBXA2R P21731 1/20 0.68
▸ PTGS1 P23219 1/20 0.68
▸ SLC6A2 P23975 1/20 0.68
▸ ADRA1A P35348 1/20 0.68
▸ OPRM1 P35372 1/20 0.68
▸ DRD3 P35462 1/20 0.68
▸ SLC6A3 Q01959 1/20 0.68
▸ KCNH2 Q12809 1/20 0.68
▸ MTR Q99707 1/20 0.68

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
SCHEMBL13046591 0.81 MTTP (0.78) MTTPCHRM2ADRA2AADORA3CHRM1
Lomitapide SCHEMBL304604 0.81 MTTP (1.00) MTTPCHRM2ADRA2AADORA3CHRM1
Lomitapide SCHEMBL29355521 0.81 MTTP (1.00) MTTPCHRM2ADRA2AADORA3CHRM1
Lomitapide SCHEMBL29367678 0.78 MTTP (1.00) MTTPCHRM2ADRA2AADORA3CHRM1
Lomitapide SCHEMBL2731380 0.78 MTTP (1.00) MTTPCHRM2ADRA2AADORA3CHRM1
SCHEMBL16104392 0.77 MTTP (0.69) MTTPCHRM2ADRA2AADORA3CHRM1
SCHEMBL16519940 0.77 MTTP (0.88) MTTPCHRM2ADRA2AADORA3CHRM1
SCHEMBL8901728 0.77 MTTP (0.85) MTTPCHRM2ADRA2AADORA3CHRM1
SCHEMBL6186640 0.77 MTTP (0.84) MTTPCHRM2ADRA2AADORA3CHRM1
SCHEMBL6600443 0.76 MTTP (0.86) MTTPCHRM2ADRA2AADORA3CHRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040023290-A1 Novel therapeutic agents that modulate enzymatic processes THERAVANCE BIOPHARMA R&D IP, LLC 2004-02-05 — — US disclosed
US-20020028943-A1 Multibinding inhibitors of microsomal triglyceride transferase protein THERAVANCE BIOPHARMA R&D IP, LLC 2002-03-07 — — US disclosed
US-6288234-B1 FLUORINATED HETEROCYCLIC AMIDO AMINE COMPOUNDS AS DRUGS ADVANCED MEDICINE, INC. 2001-09-11 — — US disclosed
EP-1085846-A2 MULTIBINDING INHIBITORS OF MICROSOMAL TRIGLYCERIDE TRANSFERASE PROTEIN Advanced Medicine, Inc. (US) 2001-03-28 — — EP disclosed
EP-0989857-A4 NOVEL THERAPEUTIC AGENTS THAT MODULATE ENZYMATIC PROCESSES ADVANCED MEDICINE INC (US) 2001-01-17 — — EP disclosed
EP-0989857-A1 NOVEL THERAPEUTIC AGENTS THAT MODULATE ENZYMATIC PROCESSES Advanced Medicine, Inc. (US) 2000-04-05 — — EP disclosed
WO-1999063929-A9 MULTIBINDING INHIBITORS OF MICROSOMAL TRIGLYCERIDE TRANSFERASE PROTEIN ADVANCED MEDICINE INC (US) 2000-03-16 — — WO disclosed
WO-1999063929-A2 MULTIBINDING INHIBITORS OF MICROSOMAL TRIGLYCERIDE TRANSFERASE PROTEIN ADVANCED MEDICINE, INC. (US) 1999-12-16 — — WO disclosed
WO-1999064037-A1 NOVEL THERAPEUTIC AGENTS THAT MODULATE ENZYMATIC PROCESSES ADVANCED MEDICINE, INC. (US) 1999-12-16 — — 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 (2 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-20020028943-A1 Multibinding inhibitors of microsomal triglyceride transferase protein MTTP, CETP, HDLBP MTTP 1/4885CHRM2 4692/4885ADRA2A 3703/4885
US-20040023290-A1 Novel therapeutic agents that modulate enzymatic processes RNASE1, ENGASE, ENTPD5 MTTP 465/4885CHRM2 3989/4885ADRA2A 4420/4885

“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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