SCHEMBL6209958

SCHEMBL6209958

CC(C)([C]=O)Oc1cccc(C(F)(F)F)c1

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.42
KDM4E B2RXH2 2/20 0.42
ATM Q13315 1/20 0.41
MAPT P10636 1/20 0.41
PPARG P37231 4/20 0.40
PPARA Q07869 1/20 0.40
ALDH1A1 P00352 2/20 0.40
POLB P06746 2/20 0.40
MRGPRX4 Q96LA9 1/20 0.40
CES2 O00748 1/20 0.40
SLC6A2 P23975 1/20 0.39
SLC6A4 P31645 1/20 0.39
SLC6A3 Q01959 1/20 0.39
TSHR P16473 1/20 0.39
MAPK1 P28482 1/20 0.39
MAOB P27338 1/20 0.39
NPSR1 Q6W5P4 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
SCHEMBL9752867 0.83 L3MBTL1 (0.42) L3MBTL1KDM4EATMMAPTPPARG
SCHEMBL2737127 0.80 L3MBTL1 (0.47) L3MBTL1KDM4EATMMAPTPPARG
SCHEMBL8709433 0.79 L3MBTL1 (0.50) L3MBTL1KDM4EATMMAPTALDH1A1
SCHEMBL6209961 0.77 ALDH1A1 (0.46) L3MBTL1KDM4EATMMAPTPPARG
SCHEMBL11527555 0.76 KIF11 (0.51) L3MBTL1KDM4EMAPTPPARGPPARA
SCHEMBL8887873 0.76 SOD1 (0.43) KDM4EMAPTALDH1A1MRGPRX4TSHR
SCHEMBL10566944 0.75 KDM4E (0.48) L3MBTL1KDM4EATMMAPTPPARG
SCHEMBL3372794 0.75 PPARG (0.51) KDM4EATMMAPTPPARGPPARA
SCHEMBL195031 0.75 KDM4E (0.46) L3MBTL1KDM4EMAPTPPARGPPARA
SCHEMBL15146324 0.75 L3MBTL1 (0.50) L3MBTL1KDM4EPPARGPPARAALDH1A1

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-20050256159-A1 1,4-disubstituted piperidine derivatives and their use as 11,betahsd1 inhibitors ASTRAZENECA AB (SE) 2005-11-17 US disclosed
EP-1556349-A1 1,4-DISUBSTITUTED PIPERIDINE DERIVATIVES AND THEIR USE AS 11-BETAHSD1 INHIBITORS Astrazeneca AB (SE) 2005-07-27 EP disclosed
WO-2004033427-A1 1,4-DISUBSTITUTED PIPERIDINE DERIVATIVES AND THEIR USE AS 11-BETAHSD1 INHIBITORS ASTRAZENECA AB (SE) 2004-04-22 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-20050256159-A1 1,4-disubstituted piperidine derivatives and their use as 11,betahsd1 inhibitors HSD11B1, HSD3B1, P4HA1 L3MBTL1 3461/4885KDM4E 1277/4885ATM 4161/4885

“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.