SCHEMBL6056468

SCHEMBL6056468

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

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 1/20 0.46
▸ FYN P06241 1/20 0.46
▸ CHRM2 P08172 1/20 0.46
▸ CYP3A4 P08684 1/20 0.46
▸ ADRA2A P08913 1/20 0.46
▸ CYP2D6 P10635 1/20 0.46
▸ DRD2 P14416 1/20 0.46
▸ ADRA2C P18825 1/20 0.46
▸ TACR2 P21452 1/20 0.46
▸ MC5R P33032 1/20 0.46
▸ DRD3 P35462 1/20 0.46
▸ MC3R P41968 1/20 0.46
▸ ALDH1A1 P00352 1/20 0.46
▸ MAPT P10636 1/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ TDP1 Q9NUW8 1/20 0.46
▸ FNTA P49354 2/20 0.46
▸ FNTB P49356 2/20 0.46
▸ TSHR P16473 1/20 0.40
▸ GPR142 Q7Z601 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
SCHEMBL7985615 0.94 FNTA (0.52) EGFRFYNCHRM2CYP3A4ADRA2A
SCHEMBL6056422 0.88 EGFR (0.43) EGFRFYNCHRM2CYP3A4ADRA2A
SCHEMBL6056535 0.81 FNTA (0.49) EGFRFYNCHRM2CYP3A4ADRA2A
SCHEMBL7623023 0.81 FNTA (0.48) FNTAFNTBTSHRGPR142L3MBTL1
SCHEMBL6056393 0.80 TDP1 (0.69) EGFRFYNCHRM2CYP3A4ADRA2A
SCHEMBL6056489 0.78 ALDH1A1 (0.48) EGFRFYNCHRM2CYP3A4ADRA2A
SCHEMBL6056493 0.78 ALDH1A1 (0.48) EGFRFYNCHRM2CYP3A4ADRA2A
SCHEMBL8366056 0.78 REN (0.48) EGFRFYNCHRM2CYP3A4ADRA2A
Hydrochloric Acid SCHEMBL8075746 0.77 ALDH1A1 (0.49) EGFRFYNCHRM2CYP3A4ADRA2A
SCHEMBL6056396 0.74 EGFR (0.46) EGFRFYNCHRM2CYP3A4ADRA2A

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 7 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-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
WO-1998057654-A1 METHODS FOR TREATMENT OF OCULAR NEOVASCULARIZATION JOHNS HOPKINS UNIVERSITY (US) 1998-12-23 — — WO disclosed
US-5576293-A TETRAPEPTIDES, ANTICARCINOGENIC AGENTS MERCK & CO., INC. (US) 1996-11-19 — — 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-20020006967-A1 METHODS OF TREATMENT OF OCULAR NEOVASCULARIZATION GGT1, FNTA, PIGO EGFR 3298/4885FYN 899/4885CHRM2 4357/4885

“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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