SCHEMBL9818868

SCHEMBL9818868

Cc1ccc2c(c1)C(CC(=O)O)C[C@@H](C)O2

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKR1B1 P15121 4/20 0.48
MAPT P10636 2/20 0.43
MEN1 O00255 1/20 0.43
ALDH1A1 P00352 1/20 0.43
GAA P10253 1/20 0.43
HTT P42858 1/20 0.43
BLM P54132 1/20 0.43
KMT2A Q03164 1/20 0.43
FFAR1 O14842 6/20 0.41
PPARG P37231 2/20 0.41
PPARD Q03181 2/20 0.41
CREBBP Q92793 2/20 0.39
BRD4 O60885 1/20 0.39
KDM4C Q9H3R0 1/20 0.39
TDP1 Q9NUW8 1/20 0.38
PKM P14618 1/20 0.37
HSD11B1 P28845 1/20 0.37
HSD11B2 P80365 1/20 0.37
LMNA P02545 1/20 0.37
TP53 P04637 1/20 0.37

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
SCHEMBL9818861 1.00 AKR1B1 (0.48) AKR1B1MAPTMEN1ALDH1A1GAA
SCHEMBL9818971 0.89 FFAR1 (0.46) AKR1B1MAPTMEN1ALDH1A1GAA
SCHEMBL9818968 0.89 FFAR1 (0.46) AKR1B1MAPTMEN1ALDH1A1GAA
SCHEMBL9818767 0.81 AKR1B1 (0.45) AKR1B1MAPTMEN1ALDH1A1GAA
SCHEMBL9818765 0.81 AKR1B1 (0.45) AKR1B1MAPTMEN1ALDH1A1GAA
SCHEMBL27347334 0.80 FFAR1 (0.60) FFAR1PPARGPPARD
SCHEMBL27347336 0.80 FFAR1 (0.60) FFAR1PPARGPPARD
SCHEMBL27347333 0.80 FFAR1 (0.60) FFAR1PPARGPPARD
SCHEMBL18643710 0.74 CREBBP (0.44) AKR1B1MAPTALDH1A1GAAKMT2A
SCHEMBL14449327 0.74 CREBBP (0.44) AKR1B1MAPTALDH1A1GAAKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0230379-B1 CHROMAN- AND THIOCHROMAN-4-ACETIC ACIDS USEFUL IN THE TREATMENT OF DIABETIC COMPLICATIONS PFIZER INC. (US) 1991-04-03 EP disclosed