SCHEMBL6885891

SCHEMBL6885891

COc1ccc(CO[C@@H]2CC[C@]3(CO3)[C@@H](C)[C@@H]2OC)cc1

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
METAP2 P50579 7/20 0.40
REN P00797 2/20 0.38
TACR1 P25103 1/20 0.35
NAAA Q02083 1/20 0.35
KCNA5 P22460 1/20 0.35
IDO1 P14902 2/20 0.35
AGXT P21549 2/20 0.35

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
SCHEMBL6884561 0.80 METAP2 (0.35) METAP2RENTACR1NAAAKCNA5
SCHEMBL9209896 0.77 METAP2 (0.63) METAP2
SCHEMBL6878395 0.77 METAP2 (0.46) METAP2RENTACR1
SCHEMBL6882901 0.73 METAP2 (0.53) METAP2
SCHEMBL6548680 0.71 REN (0.40) RENTACR1NAAAKCNA5IDO1
SCHEMBL24597253 0.69 IDO1 (0.50) RENNAAAKCNA5IDO1AGXT
SCHEMBL6883893 0.69 TACR1 (0.43) METAP2TACR1IDO1
SCHEMBL13103437 0.67 KCNA5 (0.47) RENTACR1NAAAKCNA5IDO1
SCHEMBL10348013 0.67 REN (0.39) RENTACR1NAAAKCNA5IDO1
SCHEMBL22588318 0.65 REN (0.44) RENTACR1NAAAKCNA5IDO1

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-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

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 METAP2 2357/4885REN 2405/4885TACR1 2450/4885

“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.