SCHEMBL5067829

SCHEMBL5067829

O=C(O)[C@@H]1C[C@@H](O)CN1Cc1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CD274 Q9NZQ7 4/20 0.50
GRM6 O15303 1/20 0.50
MAOA P21397 1/20 0.49
MAOB P27338 1/20 0.49
MAPT P10636 1/20 0.49
AGTR2 P50052 1/20 0.46
ACE P12821 1/20 0.46
S1PR1 P21453 1/20 0.45
S1PR5 Q9H228 1/20 0.45
KDM4E B2RXH2 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
FUCA1 P04066 2/20 0.44
PDCD1 Q15116 2/20 0.43
GBA1 P04062 1/20 0.43

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
SCHEMBL8044343 1.00 CD274 (0.50) CD274GRM6MAOAMAOBMAPT
SCHEMBL20745515 1.00 CD274 (0.50) CD274GRM6MAOAMAOBMAPT
SCHEMBL9218563 1.00 CD274 (0.50) CD274GRM6MAOAMAOBMAPT
SCHEMBL6545054 1.00 CD274 (0.50) CD274GRM6MAOAMAOBMAPT
Hydrochloric Acid SCHEMBL2495103 0.98 CD274 (0.49) CD274GRM6MAOAMAOBMAPT
SCHEMBL27508562 0.88 MAOA (0.62) GRM6MAOAMAOBMAPTKDM4E
SCHEMBL1162855 0.88 MAOA (0.62) GRM6MAOAMAOBMAPTKDM4E
SCHEMBL18347538 0.86 MAPT (0.55) CD274GRM6MAOAMAOBMAPT
SCHEMBL24938939 0.85 CYP3A4 (0.50) MAOAMAOBMAPTKDM4E
SCHEMBL4249938 0.85 CYP3A4 (0.50) MAOAMAOBMAPTKDM4E

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 27 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11993571-B2 Indole derivatives as efflux pump inhibitors RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2024-05-28 US disclosed
US-20230405002-A1 COMBINATIONS OF DIACYLGLYCEROL ACYLTRANSFERASE 2 INHIBITORS AND ACETYL-COA CARBOXYLASE INHIBITOR PFIZER INC. (US) 2023-12-21 US disclosed
US-11661410-B2 Tricyclic compounds as histone methyltransferase inhibitors GLOBAL BLOOD THERAPEUTICS, INC. (US) 2023-05-30 US disclosed
US-20230002351-A1 TRICYCLIC COMPOUNDS AS HISTONE METHYLTRANSFERASE INHIBITORS GLOBAL BLOOD THERAPEUTICS, INC. 2023-01-05 US disclosed
EP-4110394-A1 COMBINATIONS OF DIACYLGLYCEROL ACYLTRANSFERASE 2 INHIBITORS AND ACETYL-COA CARBOXYLASE INHIBITOR Pfizer Inc. (US) 2023-01-04 EP disclosed
US-11471458-B2 Diacylglycerol acyl transferase 2 inhibitor PFIZER INC. (US) 2022-10-18 US disclosed
WO-2022152852-A1 ANTAGONISTS OF MRGX2 GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2022-07-21 WO disclosed
US-11065249-B2 Diacylglycerol acyl transferase 2 inhibitor PFIZER INC. (US) 2021-07-20 US disclosed
US-20210100798-A1 DIACYLGLYCEROL ACYL TRANSFERASE 2 INHIBITOR PFIZER INC. (US) 2021-04-08 US disclosed
WO-2021064590-A1 DIACYLGLYCEROL ACYLTRANSFERASE 2 INHIBITOR PFIZER INC. (US) 2021-04-08 WO disclosed
WO-2018165611-A1 INDOLE DERIVATIVES AS EFFLUX PUMP INHIBITORS RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2018-09-13 WO disclosed
CN-106573031-A Bi-terminal pegylated integrin-binding peptides and methods of use thereof 加利福尼亚大学董事会 2017-04-19 CN disclosed
WO-2008031016-A2 HETEROCYCLIC LIGANDS FOR INTEGRIN IMAGING AND THERAPY THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2008-03-13 WO disclosed
US-20040115240-A1 Composite for attaching, growing and/or repairing of living tissues and use of said composite VIVOXID OY (FI) 2004-06-17 US disclosed
EP-1377325-A1 COMPOSITE FOR ATTACHING, GROWING AND/OR REPAIRING OF LIVING TISSUES AND USE OF SAID COMPOSITE Vivoxid Oy (FI) 2004-01-07 EP disclosed
WO-2002074356-A1 COMPOSITE FOR ATTACHING, GROWING AND/OR REPAIRING OF LIVING TISSUES AND USE OF SAID COMPOSITE VIVOXID OY (FI) 2002-09-26 WO disclosed
US-5608056-A Substituted 3-pyrrolidinylthio-carbapenems as antimicrobial agents FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1997-03-04 US disclosed
EP-0636133-A1 SUBSTITUTED 3-PYRROLIDINYLTHIO-CARBAPENEMS AS ANTIMICROBIAL AGENTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1995-02-01 EP disclosed
WO-1993021186-A1 SUBSTITUTED 3-PYRROLIDINYLTHIO-CARBAPENEMS AS ANTIMICROBIAL AGENTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1993-10-28 WO disclosed
EP-0082088-A1 Derivatives of amino acids and their therapeutic use Roques, Bernard (FR) 1983-06-22 EP 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 (7 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-11065249-B2 Diacylglycerol acyl transferase 2 inhibitor DGAT2, DGAT1, ACAT2 CD274 4832/4885GRM6 3009/4885MAOA 2466/4885
US-20230002351-A1 TRICYCLIC COMPOUNDS AS HISTONE METHYLTRANSFERASE INHIBITORS EHMT1, EHMT2, BMI1 CD274 3769/4885GRM6 2068/4885MAOA 3265/4885
US-11661410-B2 Tricyclic compounds as histone methyltransferase inhibitors EHMT1, EHMT2, BMI1 CD274 3769/4885GRM6 2068/4885MAOA 3265/4885
US-20230405002-A1 COMBINATIONS OF DIACYLGLYCEROL ACYLTRANSFERASE 2 INHIBITORS AND ACETYL-COA CARBOXYLASE INHIBITOR ACAT2, ACACB, ACACA CD274 4818/4885GRM6 3927/4885MAOA 1212/4885
US-20210100798-A1 DIACYLGLYCEROL ACYL TRANSFERASE 2 INHIBITOR DGAT2, DGAT1, ACAT2 CD274 4825/4885GRM6 3011/4885MAOA 2462/4885
US-11471458-B2 Diacylglycerol acyl transferase 2 inhibitor DGAT2, DGAT1, ACAT2 CD274 4832/4885GRM6 3009/4885MAOA 2466/4885
US-11993571-B2 Indole derivatives as efflux pump inhibitors ABCB11, ABCB1, ABCG2 CD274 4734/4885GRM6 3772/4885MAOA 135/4885

“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.