SCHEMBL8484198

SCHEMBL8484198

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

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 8/20 0.55
MMP9 P14780 8/20 0.55
MMP8 P22894 8/20 0.55
HRH4 Q9H3N8 1/20 0.46
MMP1 P03956 6/20 0.44
MME P08473 1/20 0.43
ACE P12821 1/20 0.43
CPA1 P15085 1/20 0.43
ACE2 Q9BYF1 1/20 0.43
REN P00797 3/20 0.43
MMP3 P08254 2/20 0.43
CTSS P25774 1/20 0.42
CTSK P43235 1/20 0.42
MMP14 P50281 2/20 0.41
ADAM10 O14672 1/20 0.41
ADAM12 O43184 1/20 0.41
ADAMTS4 O75173 1/20 0.41
MMP7 P09237 1/20 0.41
MMP12 P39900 1/20 0.41
MMP13 P45452 1/20 0.41

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
SCHEMBL8484193 1.00 MMP2 (0.55) MMP2MMP9MMP8HRH4MMP1
SCHEMBL8484478 0.91 MMP9 (0.47) MMP2MMP9MMP8HRH4MME
SCHEMBL8485801 0.91 CTSS (0.46) MMP2MMP9MMP8HRH4MME
SCHEMBL8484484 0.91 MMP9 (0.47) MMP2MMP9MMP8HRH4MME
SCHEMBL8485799 0.91 CTSS (0.46) MMP2MMP9MMP8HRH4MME
SCHEMBL8481408 0.90 HRH4 (0.56) MMP2MMP9MMP8HRH4MME
SCHEMBL8481399 0.90 HRH4 (0.56) MMP2MMP9MMP8HRH4MME
SCHEMBL8481892 0.90 HRH4 (0.56) MMP2MMP9MMP8HRH4MME
SCHEMBL8486197 0.89 HRH4 (0.45) MMP2MMP9MMP8HRH4MME
SCHEMBL8486193 0.89 HRH4 (0.45) MMP2MMP9MMP8HRH4MME

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