SCHEMBL967585

SCHEMBL967585

CC1(CCCN2CCCCC2)CCc2c(Br)c(O)c3c(c2O1)C1CCC3CC1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 6/20 0.36
CYP4F2 P78329 1/20 0.36
MAPT P10636 3/20 0.36
LMNA P02545 3/20 0.36
USP2 O75604 2/20 0.36
CYP2C9 P11712 2/20 0.36
KMT2A Q03164 2/20 0.36
MEN1 O00255 1/20 0.36
GSTP1 P09211 1/20 0.36
TTPA P49638 1/20 0.36
THRB P10828 1/20 0.36
CYP2C19 P33261 1/20 0.36
NR1I2 O75469 2/20 0.35
TP53 P04637 1/20 0.33
CYP3A4 P08684 1/20 0.33
ALOX15 P16050 1/20 0.33
TSHR P16473 1/20 0.33
NFKB1 P19838 1/20 0.33
THPO P40225 1/20 0.33
HIF1A Q16665 1/20 0.33

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
SCHEMBL968616 0.78 AKT1 (0.44) ALOX5LMNANR1I2AKT1
SCHEMBL968831 0.78 ALOX5 (0.44) ALOX5MAPTLMNAUSP2CYP2C9
SCHEMBL969707 0.76 CCR5 (0.43) CYP3A4TSHR
SCHEMBL969162 0.75 AKT1 (0.43) ALOX5LMNANR1I2AKT1
SCHEMBL970049 0.70 MAPT (0.50) ALOX5CYP4F2MAPTLMNAUSP2
SCHEMBL17289297 0.63 USP2 (0.67) ALOX5CYP4F2MAPTLMNAUSP2
SCHEMBL966962 0.62 CYP3A4 (0.44) ALOX5CYP4F2MAPTLMNAUSP2
SCHEMBL10366298 0.61 USP2 (0.68) ALOX5CYP4F2MAPTLMNAUSP2
SCHEMBL969039 0.61 ALOX5 (0.44) ALOX5NR1I2AKT1
SCHEMBL968168 0.61 ALOX5 (0.46) ALOX5NR1I2

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
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
US-7470798-B2 Neurodegenerative disorders; antiinflammatory agents; strokes; antiischemic agents; neuropathic pain; brain disorders; antiepileptic agents; Parkinson's disease ; amyotropic lateral sclerosis; Alzheimer's disease; antidiabetic agents EDISON PHARMACEUTICALS, INC. (US) 2008-12-30 US disclosed
US-20050065149-A1 Neurodegenerative disorders; antiinflammatory agents; strokes; antiischemic agents; neuropathic pain; brain disorders; antiepileptic agents; Parkinson's disease ; amyotropic lateral sclerosis; Alzheimer's disease; antidiabetic agents PTC THERAPEUTICS, INC. 2005-03-24 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 (2 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-20050065149-A1 Neurodegenerative disorders; antiinflammatory agents; strokes; antiischemic agents; neuropathic pain; brain disorders; antiepileptic agents; Parkinson's disease ; amyotropic lateral sclerosis; Alzheimer's disease; antidiabetic agents NLN, ACAA2, CS ALOX5 525/4885CYP4F2 3614/4885MAPT 258/4885
US-20090170814-A1 7,8-BICYCLOAKYL-CHROMAN DERIVATIVES COQ8A, TFAM, CS ALOX5 1689/4885CYP4F2 314/4885MAPT 286/4885

“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.