SCHEMBL8481273

SCHEMBL8481273

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

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ HRH4 Q9H3N8 1/20 0.47
▸ MMP9 P14780 3/20 0.42
▸ MMP8 P22894 2/20 0.42
▸ MMP2 P08253 1/20 0.42
▸ MME P08473 1/20 0.41
▸ ACE P12821 1/20 0.41
▸ CPA1 P15085 1/20 0.41
▸ ACE2 Q9BYF1 1/20 0.41
▸ REN P00797 4/20 0.40
▸ ECE1 P42892 1/20 0.39
▸ CTSS P25774 1/20 0.38
▸ CTSK P43235 1/20 0.38
▸ ANPEP P15144 2/20 0.38
▸ IL1RN P18510 2/20 0.38
▸ ERAP2 Q6P179 2/20 0.38
▸ ERAP1 Q9NZ08 2/20 0.38
▸ LNPEP Q9UIQ6 1/20 0.38
▸ MMP14 P50281 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
SCHEMBL8481278 1.00 HRH4 (0.47) HRH4MMP9MMP8MMP2MME
SCHEMBL8481408 0.91 HRH4 (0.56) HRH4MMP9MMP8MMP2MME
SCHEMBL8481399 0.91 HRH4 (0.56) HRH4MMP9MMP8MMP2MME
SCHEMBL8481892 0.91 HRH4 (0.56) HRH4MMP9MMP8MMP2MME
SCHEMBL8481136 0.89 HRH4 (0.49) HRH4MMP9MMP8MMP2MME
SCHEMBL8481151 0.88 HRH4 (0.48) HRH4MMP9MMP8MMP2MME
SCHEMBL8484193 0.88 MMP2 (0.55) HRH4MMP9MMP8MMP2MME
SCHEMBL8484198 0.88 MMP2 (0.55) HRH4MMP9MMP8MMP2MME
SCHEMBL8481144 0.88 HRH4 (0.48) HRH4MMP9MMP8MMP2MME
SCHEMBL8485799 0.88 CTSS (0.46) HRH4MMP9MMP8MMP2MME

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 2 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 disclosed
WO-1997026246-A1 SUBSTITUTED HISTIDINE INHIBITORS OF PROTEIN FARNESYLTRANSFERASE WARNER-LAMBERT COMPANY (US) 1997-07-24 — — WO disclosed
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