SCHEMBL6548680

SCHEMBL6548680

COc1ccc(CO[C@@H]2CCC(=O)[C@@H](C)[C@@H]2OC)cc1

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
REN P00797 2/20 0.40
PSEN1 P49768 1/20 0.40
PSEN2 P49810 1/20 0.40
APH1B Q8WW43 1/20 0.40
NCSTN Q92542 1/20 0.40
APH1A Q96BI3 1/20 0.40
PSENEN Q9NZ42 1/20 0.40
KCNA5 P22460 2/20 0.39
SIGMAR1 Q99720 1/20 0.38
TACR1 P25103 1/20 0.37
MAPK1 P28482 1/20 0.37
IDO1 P14902 2/20 0.37
AGXT P21549 2/20 0.37
NAAA Q02083 1/20 0.37
APP P05067 1/20 0.37

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
SCHEMBL6885649 0.79 PSEN1 (0.37) RENPSEN1PSEN2APH1BNCSTN
SCHEMBL6549228 0.79 PSEN1 (0.37) RENPSEN1PSEN2APH1BNCSTN
SCHEMBL22006160 0.76 REN (0.44) RENPSEN1PSEN2APH1BNCSTN
SCHEMBL17803300 0.76 REN (0.44) RENPSEN1PSEN2APH1BNCSTN
SCHEMBL6550961 0.74 TACR1 (0.34) RENSIGMAR1TACR1
SCHEMBL24597253 0.72 IDO1 (0.50) RENKCNA5IDO1AGXTNAAA
SCHEMBL6885891 0.71 METAP2 (0.40) RENKCNA5TACR1IDO1AGXT
SCHEMBL13103437 0.70 KCNA5 (0.47) RENKCNA5SIGMAR1TACR1IDO1
SCHEMBL6885058 0.69 IDO1 (0.38) RENIDO1AGXTNAAAAPP
SCHEMBL15032473 0.69 NAAA (0.46) SIGMAR1TACR1MAPK1IDO1AGXT

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1480964-A1 INHIBITEURS DE L'ANGIOGENESE Galderma Research & Development, S.N.C. (FR) 2004-12-01 EP disclosed
US-6803382-B2 1-OXASPIRO(2,5)OCTAN-6-OL DERIVATIVES GALDERMA RESEARCH & DEVELOPMENT, S.N.C. (FR) 2004-10-12 US disclosed
US-20030134896-A1 Novel angiogenesis inhibitors and pharmaceutical and cosmetic use thereof GALDERMA RESEARCH & DEVELOPMENT (FR) 2003-07-17 US disclosed
WO-2003040119-A1 ANGIOGENESIS INHIBITORS GALDERMA RESEARCH & DEVELOPMENT, S.N.C. (FR) 2003-05-15 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-20030134896-A1 Novel angiogenesis inhibitors and pharmaceutical and cosmetic use thereof VEGFA, KDR, FLT1 REN 2405/4885PSEN1 1915/4885PSEN2 1140/4885

“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.