SCHEMBL12656291

SCHEMBL12656291

CCN1CCC2(CC1)OC(=O)CN2CC

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ACKR3 P25106 1/20 0.33
HTR2B P41595 1/20 0.32
OPRM1 P35372 2/20 0.31
OPRD1 P41143 2/20 0.31
OPRK1 P41145 2/20 0.31
KDM4E B2RXH2 1/20 0.31
GAA P10253 1/20 0.31

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
SCHEMBL12655733 0.85 HTR2B (0.32) ACKR3HTR2BOPRM1OPRD1OPRK1
SCHEMBL12655993 0.81
SCHEMBL12656049 0.79
SCHEMBL14873763 0.71 HSD11B1 (0.37) OPRM1OPRD1OPRK1KDM4EGAA
SCHEMBL12673278 0.71 OPRM1 (0.31) OPRM1OPRD1OPRK1
SCHEMBL12656406 0.71 SIGMAR1 (0.30)
SCHEMBL2013161 0.67
SCHEMBL13074145 0.67 ACKR3 (0.40) ACKR3HTR2BKDM4EGAA
SCHEMBL12673345 0.67 KDM4E (0.41) OPRM1OPRD1OPRK1KDM4EGAA
SCHEMBL12655741 0.66 KDM4E (0.34) ACKR3OPRM1OPRD1OPRK1KDM4E

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-20110105484-A1 FILAMIN A-BINDING ANTI-INFLAMMATORY ANALGESIC PAIN THERAPEUTICS 2011-05-05 US disclosed
US-20110105481-A1 FILAMIN A BINDING ANTI-INFLAMMATORY AND ANALGESIC PAIN THERAPEUTICS 2011-05-05 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 (2 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-20110105484-A1 FILAMIN A-BINDING ANTI-INFLAMMATORY ANALGESIC FLNA, FLNB, OPRK1 ACKR3 549/4885HTR2B 1918/4885OPRM1 41/4885
US-20110105481-A1 FILAMIN A BINDING ANTI-INFLAMMATORY AND ANALGESIC FLNA, FLNB, OPRK1 ACKR3 335/4885HTR2B 1704/4885OPRM1 8/4885

“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.