SCHEMBL6143586

SCHEMBL6143586

CC1(C)CC(C)(C)c2cc(CC(=O)O)ccc2O1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP26A1 O43174 7/20 0.53
CYP26B1 Q9NR63 6/20 0.53
AKR1B1 P15121 4/20 0.49
SSTR5 P35346 1/20 0.48
RXRA P19793 1/20 0.42
RXRB P28702 1/20 0.42
RXRG P48443 1/20 0.42
SLC22A12 Q96S37 1/20 0.39
KDM4E B2RXH2 1/20 0.39
RGS12 O14924 1/20 0.39
LMNA P02545 1/20 0.39
POLB P06746 1/20 0.39
GAA P10253 1/20 0.39
MAPT P10636 1/20 0.39
HPGD P15428 1/20 0.39
TSHR P16473 1/20 0.39
NFKB1 P19838 1/20 0.39
APEX1 P27695 1/20 0.39
THPO P40225 1/20 0.39
BLM P54132 1/20 0.39

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
SCHEMBL5737195 0.86 CYP26A1 (0.47) CYP26A1CYP26B1AKR1B1SSTR5RXRA
SCHEMBL5736766 0.82 CYP26B1 (0.48) CYP26A1CYP26B1AKR1B1SSTR5RXRA
SCHEMBL9054884 0.82 SSTR5 (0.43) CYP26A1CYP26B1AKR1B1SSTR5KDM4E
SCHEMBL8876189 0.81 CYP26A1 (0.43) CYP26A1CYP26B1AKR1B1SSTR5
SCHEMBL6017351 0.79 SSTR5 (0.42) CYP26A1CYP26B1AKR1B1SSTR5MAPT
SCHEMBL17316518 0.79 CYP26A1 (0.52) CYP26A1CYP26B1RXRARXRBRXRG
SCHEMBL6144438 0.79 CYP26A1 (0.58) CYP26A1CYP26B1RXRARXRBRXRG
SCHEMBL5736575 0.78 SSTR5 (0.50) CYP26A1CYP26B1AKR1B1SSTR5RXRA
SCHEMBL13613854 0.77 AKR1B1 (0.47) CYP26A1CYP26B1AKR1B1SSTR5RXRA
SCHEMBL6146899 0.77 CYP26A1 (0.69) CYP26A1CYP26B1AKR1B1SSTR5RXRA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1293034-C New gamma selective retinoids HOFFMANN LA ROCHE (CH) 2007-01-03 CN disclosed
EP-1280757-B1 NEW GAMMA SELECTIVE RETINOIDS HOFFMANN LA ROCHE (CH) 2005-08-17 EP disclosed
US-6603012-B2 RAR selective retinoid agonists HOFFMANN-LA ROCHE INC. 2003-08-05 US disclosed
CN-1430596-A New gamma selective retinoids HOFFMANN LA ROCHE (CH) 2003-07-16 CN disclosed
EP-1280757-A2 NEW GAMMA SELECTIVE RETINOIDS F. HOFFMANN-LA ROCHE AG (CH) 2003-02-05 EP disclosed
US-20020026060-A1 RAR selective retinoid agonists F.HOFFMANN-LA ROCHE AG (CH) 2002-02-28 US disclosed
WO-2001083438-A2 NEW GAMMA SELECTIVE RETINOIDS F. HOFFMANN-LA ROCHE AG (CH) 2001-11-08 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-20020026060-A1 RAR selective retinoid agonists RARA, RARG, RARB CYP26A1 474/4885CYP26B1 923/4885AKR1B1 863/4885

“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.