SCHEMBL6132321

SCHEMBL6132321

OC1(C2CCCC2)CCC2(CC1)OCCO2

nearest known ligand 0.34

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.34
OPRM1 P35372 1/20 0.33
OPRD1 P41143 1/20 0.33
OPRK1 P41145 1/20 0.33
OPRL1 P41146 1/20 0.33
ALDH1A1 P00352 5/20 0.33
LMNA P02545 1/20 0.32
TSHR P16473 1/20 0.32
CYP2C19 P33261 1/20 0.31
GAA P10253 1/20 0.31
HPGD P15428 1/20 0.30

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
SCHEMBL613729 0.98 OPRM1 (0.36) KMT2AOPRM1OPRD1OPRK1OPRL1
SCHEMBL1119828 0.91 OPRM1 (0.31) OPRM1OPRK1OPRL1
SCHEMBL18566703 0.78 OPRM1 (0.44) OPRM1OPRD1OPRK1OPRL1LMNA
SCHEMBL31550466 0.78 OPRM1 (0.44) OPRM1OPRD1OPRK1OPRL1LMNA
SCHEMBL9999069 0.74
SCHEMBL9891 0.73 TSHR (0.40) OPRM1OPRD1OPRK1OPRL1ALDH1A1
SCHEMBL641967 0.73 TSHR (0.40) OPRM1OPRD1OPRK1OPRL1ALDH1A1
SCHEMBL4613762 0.73 TSHR (0.40) OPRM1OPRD1OPRK1OPRL1ALDH1A1
SCHEMBL24423724 0.71
SCHEMBL3708728 0.71 OPRM1 (0.43) OPRM1OPRD1OPRK1OPRL1ALDH1A1

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-6884774-B2 Cyclic hexapeptide derivatives FUJISAWA PHARMACEUTICAL CO. LTD. (JP) 2005-04-26 US disclosed
EP-1259535-B1 CYCLIC HEXAPEPTIDE DERIVATIVES FUJISAWA PHARMACEUTICAL CO (JP) 2005-04-13 EP disclosed
US-20030083238-A1 Cyclic hexapeptide derivatives ASTELLAS PHARMA INC. (JP) 2003-05-01 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-20030083238-A1 Cyclic hexapeptide derivatives NGLY1, ALG1, CHIT1 KMT2A 4695/4885OPRM1 4527/4885OPRD1 3617/4885

“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.