SCHEMBL8481703

SCHEMBL8481703

CCCNC(=O)C(Cc1c[nH]cn1)NC(=O)C(Cc1cccc2ccccc12)Cc1cccc2ccccc12

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ REN P00797 6/20 0.43
▸ CTSS P25774 1/20 0.43
▸ CTSK P43235 1/20 0.43
▸ MMP8 P22894 5/20 0.43
▸ MMP2 P08253 4/20 0.43
▸ MMP9 P14780 4/20 0.43
▸ HRH4 Q9H3N8 1/20 0.43
▸ FNTA P49354 1/20 0.43
▸ PGGT1B P53609 1/20 0.43
▸ MME P08473 1/20 0.42
▸ ACE P12821 1/20 0.42
▸ CPA1 P15085 1/20 0.42
▸ ACE2 Q9BYF1 1/20 0.42
▸ EPHX1 P07099 1/20 0.40
▸ MMP1 P03956 1/20 0.40
▸ MMP14 P50281 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
SCHEMBL8481701 1.00 REN (0.43) RENCTSSCTSKMMP8MMP2
SCHEMBL8485801 0.93 CTSS (0.46) RENCTSSCTSKMMP8MMP2
SCHEMBL8485799 0.93 CTSS (0.46) RENCTSSCTSKMMP8MMP2
SCHEMBL8485136 0.91 FNTA (0.47) RENCTSSCTSKMMP8MMP2
SCHEMBL8486470 0.91 HRH4 (0.44) RENCTSSCTSKMMP8MMP2
SCHEMBL8485139 0.91 FNTA (0.47) RENCTSSCTSKMMP8MMP2
SCHEMBL8486463 0.91 HRH4 (0.44) RENCTSSCTSKMMP8MMP2
SCHEMBL8487777 0.90 MMP1 (0.48) RENCTSSCTSKMMP8MMP2
SCHEMBL8487773 0.90 MMP1 (0.48) RENCTSSCTSKMMP8MMP2
SCHEMBL8481637 0.90 REN (0.42) RENCTSSCTSKMMP8MMP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6008372-A ANTICARCINOGENIC, ANTIRESTENOSIS AND ANTIPSORIASIS AGENT WARNER-LAMBERT COMPANY (US) 1999-12-28 — — US claimed
US-6008372-A ANTICARCINOGENIC, ANTIRESTENOSIS AND ANTIPSORIASIS AGENT WARNER-LAMBERT COMPANY (US) 1999-12-28 — — US disclosed
WO-1997026246-A1 SUBSTITUTED HISTIDINE INHIBITORS OF PROTEIN FARNESYLTRANSFERASE WARNER-LAMBERT COMPANY (US) 1997-07-24 — — WO disclosed
Send feedback