SCHEMBL6056418

SCHEMBL6056418

COC(=O)[C@H](CCSC)NC(=O)[C@H](Cc1ccccc1)NC[C@@H](NC(=O)[C@@H]1CCC(=O)N1)C(C)C

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 1/20 0.42
▸ FNTA P49354 4/20 0.42
▸ FNTB P49356 4/20 0.42
▸ PGGT1B P53609 2/20 0.42
▸ ALDH1A1 P00352 1/20 0.39
▸ THRB P10828 1/20 0.39
▸ CYP2C9 P11712 1/20 0.39
▸ CYP2C19 P33261 1/20 0.39
▸ HSD17B10 Q99714 1/20 0.39
▸ MME P08473 1/20 0.39
▸ ANPEP P15144 1/20 0.39
▸ HDAC3 O15379 1/20 0.38
▸ HDAC4 P56524 1/20 0.38
▸ HDAC1 Q13547 1/20 0.38
▸ HDAC7 Q8WUI4 1/20 0.38
▸ HDAC2 Q92769 1/20 0.38
▸ HDAC10 Q969S8 1/20 0.38
▸ HDAC11 Q96DB2 1/20 0.38
▸ HDAC8 Q9BY41 1/20 0.38
▸ HDAC6 Q9UBN7 1/20 0.38

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
SCHEMBL6056506 0.93 FNTA (0.49) FNTAFNTBPGGT1BBACE1
SCHEMBL7628732 0.88 FNTA (0.45) TSHRFNTAFNTBALDH1A1THRB
SCHEMBL6056422 0.82 EGFR (0.43) TSHRFNTAFNTBALDH1A1HDAC3
SCHEMBL6056440 0.80 FNTA (0.47) FNTAFNTBPGGT1BBACE1
SCHEMBL9074456 0.79 REN (0.54) FNTAFNTBPGGT1BBACE1
SCHEMBL10335315 0.78 GAA (0.56) TSHRALDH1A1THRBCYP2C9CYP2C19
Hydrochloric Acid SCHEMBL9074530 0.76 FNTA (0.51) FNTAFNTBPGGT1BALDH1A1THRB
Hydrochloric Acid SCHEMBL9074533 0.76 FNTA (0.51) FNTAFNTBPGGT1BALDH1A1THRB
SCHEMBL6056540 0.76 FNTA (0.51) TSHRFNTAFNTBHDAC3HDAC4
SCHEMBL6056535 0.75 FNTA (0.49) FNTAFNTBPGGT1BALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0725650-A4 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE MERCK & CO INC (US) 1999-02-03 — — EP claimed
EP-0836383-A1 COMBINATIONS OF INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE Merck & Co., Inc. (US) 1998-04-22 — — EP claimed
WO-1997001275-A1 COMBINATIONS OF INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE MERCK & CO., INC. (US) 1997-01-16 — — WO claimed
EP-0725650-A1 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE MERCK & CO. INC. (US) 1996-08-14 — — EP claimed
WO-1995009001-A1 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE MERCK & CO., INC. (US) 1995-04-06 — — WO claimed
WO-2006017369-A2 USE OF A FARNESYL TRANSFERASE INHIBITOR IN THE TREATMENT OF VIRAL INFECTIONS GOVERNMENT OF THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2006-02-16 — — WO disclosed
US-20020006967-A1 METHODS OF TREATMENT OF OCULAR NEOVASCULARIZATION CAMPOCHIARO PETER A (US) 2002-01-17 — — US disclosed
US-6160015-A ADMINISTERING TO MAMMAL A FARNESYL PROTEIN TRANSFERASE INHIBITOR UNIVERSITY OF CINCINNATI (US) 2000-12-12 — — US disclosed
EP-0840605-A4 COMPOUNDS USEFUL IN THE TREATMENT OF NEUROFIBROMATOSIS UNIV CINCINNATI (US) 2000-05-10 — — EP disclosed
EP-0725650-A4 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE MERCK & CO INC (US) 1999-02-03 — — EP disclosed
WO-1998057654-A1 METHODS FOR TREATMENT OF OCULAR NEOVASCULARIZATION JOHNS HOPKINS UNIVERSITY (US) 1998-12-23 — — WO disclosed
EP-0840605-A1 COMPOUNDS USEFUL IN THE TREATMENT OF NEUROFIBROMATOSIS University of Cincinnati (US) 1998-05-13 — — EP disclosed
EP-0836383-A1 COMBINATIONS OF INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE Merck & Co., Inc. (US) 1998-04-22 — — EP disclosed
WO-1997002817-A1 COMPOUNDS USEFUL IN THE TREATMENT OF NEUROFIBROMATOSIS UNIVERSITY OF CINCINNATI (US) 1997-01-30 — — WO disclosed
WO-1997001275-A1 COMBINATIONS OF INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE MERCK & CO., INC. (US) 1997-01-16 — — WO disclosed
US-5576293-A TETRAPEPTIDES, ANTICARCINOGENIC AGENTS MERCK & CO., INC. (US) 1996-11-19 — — US disclosed
EP-0725650-A1 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE MERCK & CO. INC. (US) 1996-08-14 — — EP disclosed
WO-1995009001-A1 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE MERCK & CO., INC. (US) 1995-04-06 — — 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-20020006967-A1 METHODS OF TREATMENT OF OCULAR NEOVASCULARIZATION GGT1, FNTA, PIGO TSHR 3816/4885FNTA 2/4885FNTB 11/4885

“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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