SCHEMBL7370024

SCHEMBL7370024

CC(C)CCCN[C@H](Cc1ccccc1)C(=O)N[C@@H](Cc1cccc2ccccc12)C(=O)N[C@H](C=O)CCCNC(=N)N

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ PSMB5 P28074 1/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ HRH4 Q9H3N8 1/20 0.42
▸ NPY4R P50391 10/20 0.42
▸ NPY1R P25929 7/20 0.42
▸ NPY5R Q15761 6/20 0.42
▸ NPY2R P49146 3/20 0.42
▸ MMP9 P14780 1/20 0.41
▸ MMP8 P22894 1/20 0.41
▸ MMP14 P50281 1/20 0.41
▸ CASP1 P29466 1/20 0.41
▸ MME P08473 1/20 0.40
▸ ACE P12821 1/20 0.40
▸ CPA1 P15085 1/20 0.40
▸ ACE2 Q9BYF1 1/20 0.40
▸ CASP3 P42574 1/20 0.40

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
SCHEMBL7368582 0.90 GNPAT (0.48) SMN1; SMN2HRH4NPY4RNPY1RMMP9
SCHEMBL7371728 0.88 OPRD1 (0.47) SMN1; SMN2HRH4NPY4RNPY1RNPY5R
SCHEMBL7374882 0.88 CTSS (0.56) PSMB5
SCHEMBL8373858 0.82 HDAC3 (0.42) SMN1; SMN2HRH4MMP9MMP8MMP14
SCHEMBL21360283 0.80 GNPAT (0.52) SMN1; SMN2NPY4RNPY1RNPY5RNPY2R
SCHEMBL21167756 0.79 F2 (0.50) SMN1; SMN2NPY4RNPY1RNPY5RNPY2R
SCHEMBL7373235 0.78 CTSS (0.53) —
SCHEMBL5966682 0.78 PSMB5 (0.49) PSMB5HRH4
SCHEMBL30028835 0.77 GNPAT (0.53) HRH4MMP9MMP8MMP14MME
SCHEMBL11144460 0.76 PSMB1 (0.58) PSMB5NPY4RNPY1RNPY5RNPY2R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0675899-B1 NOVEL INHIBITORS OF FACTOR Xa CORVAS INT INC (US) 1999-03-17 — — EP disclosed
US-5883077-A PEPTIDES ALDEHYDE ANALOGUES CORVAS INTERNATIONAL, INC. (US) 1999-03-16 — — US disclosed
EP-0675899-A4 NOVEL INHIBITORS OF FACTOR Xa. CORVAS INT INC (US) 1996-01-24 — — EP disclosed
EP-0675899-A1 NOVEL INHIBITORS OF FACTOR Xa CORVAS INTERNATIONAL, INC. (US) 1995-10-11 — — EP disclosed
WO-1994013693-A1 NOVEL INHIBITORS OF FACTOR Xa CORVAS INTERNATIONAL, INC. (US) 1994-06-23 — — WO disclosed
Send feedback