SCHEMBL5863173

SCHEMBL5863173

O=C(O)c1cccc(-c2ccc(CSCCOc3ccccc3)cc2)c1

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MRGPRX4 Q96LA9 3/20 0.53
NR4A2 P43354 2/20 0.53
KMO O15229 1/20 0.50
NR1H4 Q96RI1 2/20 0.48
LMNA P02545 1/20 0.47
GAA P10253 1/20 0.47
RXRA P19793 1/20 0.46
RXRB P28702 1/20 0.46
KMT2A Q03164 1/20 0.46
FFAR1 O14842 1/20 0.45
FFAR4 Q5NUL3 1/20 0.45
PDE7A Q13946 1/20 0.45
PDE7B Q9NP56 1/20 0.45
BCL2L1 Q07817 1/20 0.45
MCL1 Q07820 1/20 0.45
SMPD1 P17405 1/20 0.44

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
SCHEMBL5863189 0.91 NR4A2 (0.57) MRGPRX4NR4A2KMONR1H4KMT2A
SCHEMBL5863142 0.89 PKM (0.58) NR4A2GAARXRARXRB
SCHEMBL5863160 0.88 NR4A2 (0.53) MRGPRX4NR4A2NR1H4RXRARXRB
SCHEMBL5863113 0.87 MEN1 (0.51) KMT2A
SCHEMBL5863212 0.82 PTGER1 (0.49) MRGPRX4NR4A2KMONR1H4KMT2A
SCHEMBL5863110 0.81 FYN (0.48) LMNABCL2L1MCL1
SCHEMBL6256752 0.80 DCLRE1B (0.52) NR4A2FFAR1FFAR4MCL1
SCHEMBL5863289 0.80 FYN (0.50) LMNAKMT2A
Oxalic Acid SCHEMBL5863295 0.80 FYN (0.47) LMNA
SCHEMBL5863076 0.78 MEN1 (0.52) KMT2A

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 8 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 claimed
US-20060052449-A1 Novel mch receptor antagonists ELI LILLY AND COMPANY 2006-03-09 US claimed
EP-1572637-A1 NOVEL MCH RECEPTOR ANTAGONISTS ELI LILLY AND COMPANY (US) 2005-09-14 EP claimed
WO-2004052848-A1 NOVEL MCH RECEPTOR ANTAGONISTS ELI LILLY AND COMPANY (US) 2004-06-24 WO claimed
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 MRGPRX4 90/4885NR4A2 341/4885KMO 560/4885

“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.