SCHEMBL5174356

SCHEMBL5174356

Cc1cc(C)c2c(c1)C(CC=O)CCC2

nearest known ligand 0.53

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
UGT2B17 O75795 2/20 0.53
KDM4C Q9H3R0 1/20 0.45
SIGMAR1 Q99720 1/20 0.37
CRBN Q96SW2 1/20 0.31
MAPT P10636 1/20 0.31
KMT2A Q03164 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
SCHEMBL15825377 0.79 UGT2B17 (0.57) UGT2B17KDM4CSIGMAR1
SCHEMBL15286569 0.79 UGT2B17 (0.62) UGT2B17KDM4CSIGMAR1
SCHEMBL5173559 0.78 UGT2B17 (0.60) UGT2B17KDM4CSIGMAR1
SCHEMBL13229181 0.77 ACHE (0.38) KMT2A
SCHEMBL15287102 0.76 UGT2B17 (0.57) UGT2B17KDM4CSIGMAR1KMT2A
SCHEMBL5482952 0.74 UGT2B17 (0.46) UGT2B17KDM4C
SCHEMBL15286607 0.74 KDM4C (0.52) UGT2B17KDM4CSIGMAR1MAPTKMT2A
Hydrochloric Acid SCHEMBL1976240 0.71 UGT2B17 (0.61) UGT2B17KDM4CSIGMAR1
SCHEMBL5474630 0.71 UGT2B17 (0.51) UGT2B17KDM4CSIGMAR1
SCHEMBL5272877 0.69 UGT2B17 (0.62) UGT2B17KDM4CSIGMAR1

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-1869013-A1 SUBSTITUTED CHROMAN DERIVATIVES, METHOD FOR THE PRODUCTION AND THE USE THEREOF IN THE FORM OF ANTIPHLOGISTICS Bayer Schering Pharma Aktiengesellschaft (DE) 2007-12-26 EP disclosed
US-20070129358-A1 Sbstituted chroman derivatives, processes for their preparation and their use as antiinflammatory agents SCHERING AG (DE) 2007-06-07 US disclosed
WO-2006108711-A1 SUBSTITUTED CHROMAN DERIVATIVES, METHOD FOR THE PRODUCTION AND THE USE THEREOF IN THE FORM OF ANTIPHLOGISTICS BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2006-10-19 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-20070129358-A1 Sbstituted chroman derivatives, processes for their preparation and their use as antiinflammatory agents TNF, CXCL8, MPO UGT2B17 500/4885KDM4C 3261/4885SIGMAR1 1559/4885

“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.