SCHEMBL6090244

SCHEMBL6090244

CCC(O)CCc1cccc2occc12

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 2/20 0.42
MTNR1B P49286 2/20 0.42
EED O75530 3/20 0.38
GPR35 Q9HC97 1/20 0.38
OPRM1 P35372 5/20 0.37
OPRK1 P41145 5/20 0.37
HDAC1 Q13547 1/20 0.35
SLC6A2 P23975 1/20 0.33
SLC6A4 P31645 1/20 0.33
SLC6A3 Q01959 1/20 0.33
KCNA3 P22001 1/20 0.33

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
SCHEMBL3793134 0.79 MTNR1A (0.49) MTNR1AMTNR1BEEDOPRM1OPRK1
SCHEMBL347860 0.76 MTNR1A (0.47) MTNR1AMTNR1BEEDOPRM1OPRK1
SCHEMBL3794946 0.75 MTNR1A (0.51) MTNR1AMTNR1BEEDOPRM1OPRK1
SCHEMBL7278098 0.74 TDP1 (0.47) MTNR1A
SCHEMBL9911545 0.72 MTNR1A (0.47) MTNR1AMTNR1BEEDOPRM1OPRK1
SCHEMBL2094789 0.72 EED (0.44) MTNR1AMTNR1BEEDOPRM1OPRK1
SCHEMBL9911358 0.72 GABRA1 (0.48) MTNR1AMTNR1BEEDOPRM1OPRK1
SCHEMBL5986566 0.71 MTNR1A (0.49) MTNR1AMTNR1BEEDOPRM1OPRK1
SCHEMBL27921496 0.71 EED (0.46) MTNR1AMTNR1BEEDOPRM1OPRK1
SCHEMBL5357479 0.71 MAOB (0.47) MTNR1AMTNR1BEEDOPRM1OPRK1

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-20060235222-A1 Indole-derivative modulators of steroid hormone nuclear receptors ELI LILLY AND COMPANY (US) 2006-10-19 US disclosed
EP-1597254-A1 INDOLE-DERIVATIVE MODULATORS OF STEROID HORMONE NUCLEAR RECEPTORS Eli Lilly and Company (US) 2005-11-23 EP disclosed
WO-2004067529-A1 INDOLE-DERIVATIVE MODULATORS OF STEROID HORMONE NUCLEAR RECEPTORS ELI LILLY AND COMPANY (US) 2004-08-12 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-20060235222-A1 Indole-derivative modulators of steroid hormone nuclear receptors NR3C2, NR5A1, MC2R MTNR1A 32/4885MTNR1B 39/4885EED 3105/4885

“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.