SCHEMBL4986798

SCHEMBL4986798

CCN(C)C(=O)C(N)c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 2/20 0.44
▸ KDM4E B2RXH2 1/20 0.43
▸ ATM Q13315 1/20 0.43
▸ TDP1 Q9NUW8 1/20 0.42
▸ AOC3 Q16853 2/20 0.41
▸ GAA P10253 1/20 0.41
▸ LMNA P02545 1/20 0.41
▸ CYP1A2 P05177 1/20 0.41
▸ CYP2D6 P10635 1/20 0.41
▸ MEN1 O00255 2/20 0.40
▸ KMT2A Q03164 2/20 0.40
▸ CRHBP P24387 1/20 0.40
▸ CRHR2 Q13324 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ CYP3A4 P08684 1/20 0.40
▸ ALOX5 P09917 1/20 0.40
▸ SLC6A2 P23975 1/20 0.39
▸ SLC6A4 P31645 1/20 0.39
▸ SLC6A3 Q01959 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
SCHEMBL5664149 0.86 KDM4E (0.48) SMN1; SMN2KDM4EATMTDP1AOC3
SCHEMBL4991700 0.84 SMN1; SMN2 (0.57) SMN1; SMN2GAALMNACYP1A2CYP2D6
SCHEMBL9019184 0.84 SMN1; SMN2 (0.57) SMN1; SMN2GAALMNACYP1A2CYP2D6
SCHEMBL14102623 0.83 KDM4E (0.46) KDM4EATMGAACYP1A2MEN1
SCHEMBL5004390 0.83 KDM4E (0.46) KDM4EATMGAACYP1A2MEN1
SCHEMBL4192663 0.83 HPGD (0.59) SMN1; SMN2TDP1MEN1KMT2AALDH1A1
SCHEMBL2746465 0.83 KDM4E (0.48) KDM4EATMTDP1AOC3GAA
SCHEMBL4204369 0.83 HPGD (0.59) SMN1; SMN2TDP1MEN1KMT2AALDH1A1
SCHEMBL5664359 0.82 KDM4E (0.44) KDM4EATMGAACYP1A2BCHE
Hydrochloric Acid SCHEMBL4940483 0.82 KDM4E (0.44) KDM4EATMGAACYP1A2MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040132745-A1 Microsomal triglyceride transfer protein inhibitor PFIZER INC 2004-07-08 — — US claimed
US-20090275749-A1 PRODUCTION METHOD OF OPTICALLY ACTIVE PIPERAZINE COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-11-05 — — US disclosed
US-7468378-B2 Substituted quinoline compounds PFIZER INC. (US) 2008-12-23 — — US disclosed
US-7393958-B2 Triamide-substituted heterobicyclic compounds PFIZER, INC. (US) 2008-07-01 — — US disclosed
US-7368573-B2 Triamide-substituted heterobicyclic compounds PFIZER INC. (US) 2008-05-06 — — US disclosed
US-20070093525-A1 Triamide-substituted heterobicyclic compounds PFIZER INC 2007-04-26 — — US disclosed
EP-1716137-A1 SUBSTITUTED QUINOLINE COMPOUNDS Pfizer Products Incorporated (US) 2006-11-02 — — EP disclosed
US-20060223851-A1 TRIAMIDE-SUBSTITUTED HETEROBICYCLIC COMPOUNDS BERTINATO PETER 2006-10-05 — — US disclosed
US-20050234099-A1 Substituted quinoline compounds PFIZER INC 2005-10-20 — — US disclosed
EP-1578725-A1 MICROSOMAL TRIGLYCERIDE TRANSFER PROTEIN INHIBITORS Pfizer Products Inc. (US) 2005-09-28 — — EP disclosed
WO-2005080373-A1 SUBSTITUTED QUINOLINE COMPOUNDS PFIZER PRODUCTS INC. (US) 2005-09-01 — — WO disclosed
WO-2004056777-A1 MICROSOMAL TRIGLYCERIDE TRANSFER PROTEIN INHIBITORS PFIZER PRODUCTS INC. (US) 2004-07-08 — — WO disclosed
US-20040132745-A1 Microsomal triglyceride transfer protein inhibitor PFIZER INC 2004-07-08 — — 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 (5 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-20040132745-A1 Microsomal triglyceride transfer protein inhibitor MTTP, CETP, APOB SMN1; SMN2 4591/4885KDM4E 3437/4885ATM 2710/4885
US-20090275749-A1 PRODUCTION METHOD OF OPTICALLY ACTIVE PIPERAZINE COMPOUND CYP51A1, CYP4Z1, CYP4A11 SMN1; SMN2 4037/4885KDM4E 733/4885ATM 4450/4885
US-20050234099-A1 Substituted quinoline compounds APOB, APOL1, MTPN SMN1; SMN2 3429/4885KDM4E 3678/4885ATM 3042/4885
US-20060223851-A1 TRIAMIDE-SUBSTITUTED HETEROBICYCLIC COMPOUNDS APOB, MTPN, CTRB1 SMN1; SMN2 3878/4885KDM4E 4358/4885ATM 3376/4885
US-20070093525-A1 Triamide-substituted heterobicyclic compounds APOB, MTPN, CTRB1 SMN1; SMN2 3878/4885KDM4E 4358/4885ATM 3376/4885

“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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