SCHEMBL6089239

SCHEMBL6089239

CCOc1cc2c(cc1C(C)Nc1ccc(C(=O)O)cc1)C(C(C)C)=CCC2(C)C

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HNF4A P41235 7/20 0.45
RXRA P19793 6/20 0.45
RARB P10826 7/20 0.38
RARA P10276 6/20 0.38
RARG P13631 5/20 0.38
TSHR P16473 1/20 0.37
POLB P06746 2/20 0.37
MAPT P10636 1/20 0.37
THRB P10828 1/20 0.37
SSTR5 P35346 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.35
MEN1 O00255 1/20 0.35
LMNA P02545 1/20 0.35
GAA P10253 1/20 0.35
KMT2A Q03164 1/20 0.35
MCL1 Q07820 1/20 0.35
TDP1 Q9NUW8 1/20 0.35

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
SCHEMBL6085531 0.91 MAPT (0.39) HNF4ARXRARARBRARAMAPT
SCHEMBL6086323 0.90 POLB (0.44) HNF4ARXRARARBRARARARG
SCHEMBL6086197 0.88 RXRA (0.39) HNF4ARXRARARBRARARARG
SCHEMBL6085515 0.85 PPIA (0.42) POLBMAPTTHRBMEN1GAA
SCHEMBL6089235 0.83 HNF4A (0.42) HNF4ARXRARARBRARARARG
SCHEMBL6085816 0.82 MAPT (0.34) RARBRARARARGMAPTMEN1
SCHEMBL6086650 0.80 POLB (0.44) HNF4ARXRARARBRARARARG
SCHEMBL6089231 0.79 RXRA (0.47) HNF4ARXRA
SCHEMBL6086244 0.78 POLB (0.42) HNF4ARXRARARBRARARARG
SCHEMBL6087378 0.77 MAPT (0.41) MAPTTHRBL3MBTL1MEN1GAA

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-7026487-B2 Amines substituted with a dihydronaphthalenyl, chromenyl, or thiochromenyl group, a pyridyl group and an alkyl group, having retinoid-like biological activity ALLERGAN, INC. (US) 2006-04-11 US disclosed
US-20040097733-A1 Amines substituted with a dihydronaphthalenyl, chromenyl, or thiochromenyl group, an aryl or heteroaryl group and an alkyl group, having retinoid-like biological activity BEARD RICHARD L (US) 2004-05-20 US disclosed
US-20030166932-A1 Amines substituted with a dihydronaphthalenyl, chromenyl, or thiochromenyl group, an aryl or heteroaryl group and an alkyl group, having retinoid-like biological activity ALLERGAN SALES, INC. 2003-09-04 US disclosed
US-6613917-B1 Retinoid agonist, antagonist or negative hormone-like biological activity ALLERGAN, INC. 2003-09-02 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 (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-20030166932-A1 Amines substituted with a dihydronaphthalenyl, chromenyl, or thiochromenyl group, an aryl or heteroaryl group and an alkyl group, having retinoid-like biological activity NR4A1, NR2E3, NR0B1 HNF4A 157/4885RXRA 13/4885RARB 5/4885
US-20040097733-A1 Amines substituted with a dihydronaphthalenyl, chromenyl, or thiochromenyl group, an aryl or heteroaryl group and an alkyl group, having retinoid-like biological activity NR4A1, NR2E3, NR0B1 HNF4A 157/4885RXRA 13/4885RARB 5/4885

“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.