SCHEMBL6904466

SCHEMBL6904466

COC(=O)c1ccc(C(=O)c2cc3c(cc2C)C(C)(C)C(C)C3(C)C)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXRA P19793 4/20 0.54
RXRB P28702 2/20 0.48
RXRG P48443 2/20 0.48
RARA P10276 1/20 0.48
RARB P10826 1/20 0.48
RARG P13631 1/20 0.48
TDP1 Q9NUW8 1/20 0.44
MAPT P10636 5/20 0.40
CA1 P00915 3/20 0.40
CA2 P00918 3/20 0.40
KDM4E B2RXH2 2/20 0.40
CA12 O43570 2/20 0.40
CA7 P43166 2/20 0.40
CA9 Q16790 2/20 0.40
CA14 Q9ULX7 2/20 0.40
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
ALDH1A1 P00352 3/20 0.38
GAA P10253 2/20 0.38

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
SCHEMBL6908235 0.86 RXRA (0.74) RXRARXRBRXRGRARARARB
SCHEMBL13716998 0.83 RXRA (0.50) RXRARXRBRXRGRARARARB
SCHEMBL10355823 0.83 CYP3A4 (0.43) RXRARXRBRXRGRARBRARG
SCHEMBL27804194 0.82 RXRA (0.60) RXRARXRBRXRGRARARARB
SCHEMBL3982018 0.82 RXRA (0.72) RXRARXRBRXRGRARARARB
SCHEMBL24055801 0.78 RXRA (0.46) RXRARXRBRXRGRARARARB
SCHEMBL24055013 0.77 RXRA (0.65) RXRARXRBRXRGRARARARB
SCHEMBL9185753 0.75 CYP3A4 (0.50) RXRATDP1MAPTCA1CA2
SCHEMBL9746239 0.74 PTPN11 (0.48) RXRARARARARBRARGCA1
SCHEMBL11677735 0.74 RXRA (0.68) RXRARXRBRXRGRARARARB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040162354-A1 Treatment of disease states which result from neoplastic cell proliferation using PPAR-gamma activators and compositions useful therefor THE SALK INSTITUTE FOR BIOLOGICAL STUDIES 2004-08-19 US disclosed
US-6646008-B1 Administering peroxisome proliferator activated receptor(PPAR) and retinoid acid receptor agonists such as 6-(1-(3,5,5,8,8-pentamethyl-5,6,7,8-tetrahydronaphthalen-2-yl)cyclopropyl) nicotinic acid, for prophylaxis of tumors THE SALK INSTITUTE FOR BIOLOGICAL STUDIES 2003-11-11 US disclosed
US-6586455-B1 Administering retinoid and peroxisome proliferator-activated receptors to improve cell proliferation and differentiation of adipocytes; prophylaxis of cancer THE SALK INSTITUTE FOR BIOLOGICAL STUDIES 2003-07-01 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-20040162354-A1 Treatment of disease states which result from neoplastic cell proliferation using PPAR-gamma activators and compositions useful therefor PPARA, PPARG, PPARD RXRA 6/4885RXRB 5/4885RXRG 4/4885

“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.