SCHEMBL6071739

SCHEMBL6071739

COc1c(C)ccc2c3cccc(Cl)c3n(CC3CCCCC3)c12

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ OPRM1 P35372 1/20 0.39
▸ OPRK1 P41145 1/20 0.39
▸ OPRL1 P41146 1/20 0.39
▸ CNR1 P21554 6/20 0.38
▸ KCNH2 Q12809 1/20 0.37
▸ CNR2 P34972 4/20 0.36
▸ ACHE P22303 3/20 0.36
▸ NPBWR1 P48145 1/20 0.35
▸ NOX4 Q9NPH5 1/20 0.35
▸ ABCC1 P33527 1/20 0.35
▸ PLA2G2A P14555 1/20 0.34
▸ DYRK1A Q13627 2/20 0.34
▸ HTR4 Q13639 1/20 0.34
▸ SIGMAR1 Q99720 1/20 0.34

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
SCHEMBL5022796 0.80 CNR1 (0.42) CNR1CNR2ACHEPLA2G2AHTR4
SCHEMBL5022752 0.72 ACHE (0.41) CNR1CNR2ACHEHTR4SIGMAR1
SCHEMBL5022760 0.71 CNR1 (0.44) CNR1CNR2
SCHEMBL5022790 0.70 CNR1 (0.44) CNR1CNR2
SCHEMBL1241824 0.63 SMN1; SMN2 (0.44) ACHESIGMAR1
SCHEMBL5162888 0.62 PLA2G2A (0.48) CNR1CNR2ABCC1PLA2G2A
SCHEMBL3518620 0.61 ADRA2A (0.45) OPRM1OPRK1OPRL1CNR1KCNH2
SCHEMBL3518278 0.60 CNR1 (0.66) CNR1CNR2
SCHEMBL3520860 0.60 CNR1 (0.66) CNR1KCNH2CNR2
SCHEMBL3236165 0.60 RAB9A (0.50) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060178418-A1 Novel tricyclic compounds useful for the treatment of inflammatory and allergic disorders:process for their preparation and pharmaceutical compositions containing them GLENMARK PHARMACEUTICALS LTD. (IN) 2006-08-10 — — US 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-20060178418-A1 Novel tricyclic compounds useful for the treatment of inflammatory and allergic disorders:process for their preparation and pharmaceutical compositions containing them LTC4S, TSLP, GPR119 OPRM1 1299/4885OPRK1 305/4885OPRL1 194/4885

“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.

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