SCHEMBL6800028

SCHEMBL6800028

CCOCO[C@H](CC)c1cc(F)c(F)cc1CCC(=O)OCC

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 3/20 0.39
CYP4A11 Q02928 3/20 0.39
PKM P14618 1/20 0.34
ALDH1A1 P00352 3/20 0.34
GAA P10253 1/20 0.34
DPP4 P27487 1/20 0.34
LMNA P02545 3/20 0.33
KDM4E B2RXH2 2/20 0.32
HPGD P15428 1/20 0.32
CYP1A2 P05177 1/20 0.31
PTPN1 P18031 1/20 0.31
TNF P01375 1/20 0.31
HSD17B10 Q99714 1/20 0.31
PDE3B Q13370 1/20 0.30
PDE3A Q14432 1/20 0.30
P2RY12 Q9H244 1/20 0.30
MAPT P10636 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
SCHEMBL13265232 0.87 CYP4F2 (0.40) CYP4F2CYP4A11PKMALDH1A1GAA
SCHEMBL12202099 0.86 CYP4F2 (0.40) CYP4F2CYP4A11ALDH1A1GAALMNA
SCHEMBL13265175 0.83 CYP4F2 (0.42) CYP4F2CYP4A11ALDH1A1GAALMNA
SCHEMBL12203881 0.81 CYP4F2 (0.40) CYP4F2CYP4A11ALDH1A1GAALMNA
SCHEMBL13263963 0.81 CYP4F2 (0.40) CYP4F2CYP4A11ALDH1A1GAALMNA
SCHEMBL6745216 0.81 CYP4F2 (0.36) CYP4F2CYP4A11PKMALDH1A1GAA
SCHEMBL12202110 0.79 CYP4F2 (0.38) CYP4F2CYP4A11ALDH1A1GAALMNA
SCHEMBL12202857 0.74 CYP4F2 (0.39) CYP4F2CYP4A11ALDH1A1GAALMNA
SCHEMBL6798291 0.73 CYP4F2 (0.39) CYP4F2CYP4A11ALDH1A1GAALMNA
SCHEMBL10164961 0.73 CYP4F2 (0.39) CYP4F2CYP4A11ALDH1A1GAALMNA

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-8183272-B2 Indanyl compounds DAIICHI SANKYO COMPANY, LIMITED (JP) 2012-05-22 US disclosed
US-20110319359-A1 INDANYL COMPOUNDS DAIICHI SANKYO COMPANY, LIMITED (JP) 2011-12-29 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-20110319359-A1 INDANYL COMPOUNDS RYR2, ORAI1, CASR CYP4F2 868/4885CYP4A11 403/4885PKM 3505/4885

“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.