SCHEMBL5371705

SCHEMBL5371705

Cc1ccc(C2(O)CCN(C(=O)O)CC2)cc1

nearest known ligand 0.58

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 4/20 0.55
OPRK1 P41145 4/20 0.55
OPRL1 P41146 4/20 0.55
OPRD1 P41143 2/20 0.55
CYP46A1 Q9Y6A2 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
DRD2 P14416 1/20 0.47
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
HTR2C P28335 1/20 0.46
POLB P06746 1/20 0.43
ALDH1A1 P00352 1/20 0.43

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
SCHEMBL1581749 0.95 OPRM1 (0.51) OPRM1OPRK1OPRL1OPRD1CYP46A1
SCHEMBL795975 0.84 ALDH1A1 (0.56) OPRM1OPRK1OPRL1OPRD1DRD2
SCHEMBL1427539 0.83 CA12 (0.57) OPRM1OPRK1OPRL1OPRD1DRD2
SCHEMBL5368030 0.83 CYP46A1 (0.41) OPRM1OPRK1OPRL1OPRD1CYP46A1
SCHEMBL2229509 0.83 MEN1 (0.62) OPRM1OPRK1OPRL1OPRD1SMN1; SMN2
SCHEMBL4725181 0.83 OPRM1 (0.55) OPRM1OPRK1OPRL1OPRD1SMN1; SMN2
SCHEMBL16874836 0.82 OPRM1 (0.59) OPRM1OPRK1OPRL1OPRD1SMN1; SMN2
SCHEMBL5376169 0.82 POLB (0.46) OPRM1OPRK1OPRL1OPRD1CYP46A1
SCHEMBL5373048 0.81 OPRM1 (0.60) OPRM1OPRK1OPRL1OPRD1CYP46A1
SCHEMBL14372230 0.81 OPRM1 (0.47) OPRM1OPRK1OPRL1OPRD1CYP46A1

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
EP-1714961-B1 INDAZOLE COMPOUND AND PHARMACEUTICAL USE THEREOF MITSUBISHI TANABE PHARMA CORP (JP) 2015-12-09 EP disclosed
US-20070173537-A1 Indazole compound and pharmaceutical use thereof MITSUBISHI PHARMA CORPORATION (JP) 2007-07-26 US disclosed
EP-1714961-A1 INDAZOLE COMPOUND AND PHARMACEUTICAL USE THEREOF Mitsubishi Pharma Corporation (JP) 2006-10-25 EP 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-20070173537-A1 Indazole compound and pharmaceutical use thereof CYP3A5, CYP3A43, TP53 OPRM1 3770/4885OPRK1 3177/4885OPRL1 3885/4885

“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.