SCHEMBL5863152

SCHEMBL5863152

CCOC(=O)c1cccc(-c2ccc(CSCCO)cc2)c1

nearest known ligand 0.62

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CA2 P00918 1/20 0.54
CYP4F2 P78329 1/20 0.51
CYP4A11 Q02928 1/20 0.51
TP53 P04637 1/20 0.46
POLB P06746 1/20 0.46
HPGD P15428 1/20 0.46
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45

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
SCHEMBL5863053 0.91 CYP4F2 (0.55) CA2CYP4F2CYP4A11TP53POLB
SCHEMBL5863075 0.88 BCL2 (0.49) CA2CYP4F2CYP4A11NPC1RAB9A
SCHEMBL5863054 0.87 CA2 (0.49) CA2HPGDNPC1RAB9A
SCHEMBL5863113 0.84 MEN1 (0.51) CA2POLBNPC1RAB9A
SCHEMBL8873010 0.83 CYP4F2 (0.56) CYP4F2CYP4A11TP53POLBHPGD
SCHEMBL4193217 0.81 TP53 (0.61) CA2CYP4F2CYP4A11TP53POLB
SCHEMBL5863108 0.81 CYP4F2 (0.46) CA2CYP4F2CYP4A11TP53POLB
SCHEMBL27542212 0.80 NPC1 (0.52) CYP4F2CYP4A11TP53POLBHPGD
SCHEMBL29617015 0.80 TP53 (0.62) CA2CYP4F2CYP4A11TP53POLB
SCHEMBL8873024 0.79 NPC1 (0.55) CYP4F2CYP4A11TP53POLBHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7132456-B2 MCH receptor antagonists ELI LILLY AND COMPANY (US) 2006-11-07 US disclosed
US-20060052449-A1 Novel mch receptor antagonists ELI LILLY AND COMPANY 2006-03-09 US disclosed
EP-1572637-A1 NOVEL MCH RECEPTOR ANTAGONISTS ELI LILLY AND COMPANY (US) 2005-09-14 EP disclosed
WO-2004052848-A1 NOVEL MCH RECEPTOR ANTAGONISTS ELI LILLY AND COMPANY (US) 2004-06-24 WO 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-20060052449-A1 Novel mch receptor antagonists MCHR1, MCHR2, MC1R CA2 2525/4885CYP4F2 3158/4885CYP4A11 1583/4885

“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.