SCHEMBL968258

SCHEMBL968258

CCC1C=Cc2c(CC=C(C)C)c(O)c3c(c2O1)C1CCC3C1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABCG2 Q9UNQ0 2/20 0.36
MEN1 O00255 2/20 0.34
POLB P06746 2/20 0.34
MAPT P10636 2/20 0.34
KMT2A Q03164 2/20 0.34
XBP1 P17861 1/20 0.34
GABRA1 P14867 1/20 0.33
GABRB2 P47870 1/20 0.33
IDO1 P14902 2/20 0.32
ESR2 Q92731 3/20 0.32
ESR1 P03372 2/20 0.32
SLC22A12 Q96S37 2/20 0.32
SLC2A9 Q9NRM0 2/20 0.32
CACNA1H O95180 2/20 0.32
CACNA1G O43497 1/20 0.32
AKR1B10 O60218 1/20 0.32
AKR1B1 P15121 1/20 0.32
MAOA P21397 1/20 0.32
XDH P47989 1/20 0.32
CYP3A4 P08684 1/20 0.32

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
SCHEMBL970067 0.77 PTPN1 (0.46) MEN1POLBMAPTKMT2ACYP3A4
SCHEMBL968657 0.67 PDE9A (0.41) ABCG2MEN1POLBMAPTKMT2A
SCHEMBL969511 0.62 CYP3A4 (0.50) MEN1POLBMAPTKMT2ACYP3A4
SCHEMBL968269 0.62 ABCG2 (0.35) ABCG2MEN1POLBMAPTKMT2A
SCHEMBL967680 0.62 CYP19A1 (0.41) ABCG2MAOA
SCHEMBL968424 0.61 ALOX5 (0.45)
SCHEMBL970035 0.55 CYP19A1 (0.41) ABCG2MEN1POLBMAPTKMT2A
SCHEMBL20562001 0.55 PTGS1 (0.32)
SCHEMBL11178136 0.53 MAOB (0.53) MEN1KMT2AMAOA
SCHEMBL31570921 0.53 ABCG2 (1.00) ABCG2MEN1POLBMAPTKMT2A

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-7875607-B2 Neurodegenerative disorders; antiinflammatory agents; antiischemic agents; neuropathic pain; antiepileptic agents; Parkinson's disease; Alzheimer's disease; antidiabetic agents; 3-(6-Hydroxy-2-methyl-3,4,7,8,9,10-hexahydro-7,10-methano-2H -benzo[h]chromen-2-yl)-propionic acid methyl ester AMPERE LIFE SCIENCES, INC. (US) 2011-01-25 US disclosed
US-20090170814-A1 7,8-BICYCLOAKYL-CHROMAN DERIVATIVES EDISON PHARMACEUTICALS, INC. (US) 2009-07-02 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-20090170814-A1 7,8-BICYCLOAKYL-CHROMAN DERIVATIVES COQ8A, TFAM, CS ABCG2 518/4885MEN1 3900/4885POLB 1012/4885

“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.