SCHEMBL11265231

SCHEMBL11265231

Cc1cccc(-c2c(C)n(C)c3ccc(OC(C)(C)C(=O)O)cc23)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN7 P35236 1/20 0.46
DUSP3 P51452 1/20 0.46
PTPN12 Q05209 1/20 0.46
PTPN22 Q9Y2R2 1/20 0.46
PPARG P37231 8/20 0.44
PPARA Q07869 5/20 0.44
PPARD Q03181 3/20 0.44
CYP2C19 P33261 2/20 0.44
CYP2C9 P11712 1/20 0.44
KDM4E B2RXH2 3/20 0.41
ALDH1A1 P00352 3/20 0.41
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
MAPT P10636 2/20 0.41
TDP1 Q9NUW8 1/20 0.41
PADI4 Q9UM07 1/20 0.41
POLB P06746 1/20 0.39
HTT P42858 1/20 0.39
GFER P55789 1/20 0.39
SMN1; SMN2 Q16637 2/20 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
SCHEMBL11497969 0.93 PTPN7 (0.50) PTPN7DUSP3PTPN12PTPN22PPARG
SCHEMBL11254973 0.89 PPARG (0.46) PTPN7DUSP3PTPN12PTPN22PPARG
SCHEMBL11264502 0.87 PPARA (0.44) PPARGPPARACYP2C19CYP2C9KDM4E
SCHEMBL11254123 0.87 PPARG (0.47) PTPN7DUSP3PTPN12PTPN22PPARG
SCHEMBL11257941 0.85 LMNA (0.47) PTPN7DUSP3PTPN12PTPN22PPARG
SCHEMBL11252541 0.84 PPARA (0.53) PTPN7DUSP3PTPN12PTPN22PPARG
Hydrochloric Acid SCHEMBL11259145 0.83 PTPN7 (0.43) PTPN7DUSP3PTPN12PTPN22PPARG
SCHEMBL11267392 0.81 PTPN7 (0.46) PTPN7DUSP3PTPN12PTPN22PPARG
SCHEMBL11290711 0.81 PPARA (0.47) PPARGPPARACYP2C19CYP2C9KDM4E
SCHEMBL11262582 0.77 PTPN7 (0.44) PTPN7DUSP3PTPN12PTPN22PPARG

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
EP-0015523-B1 INDOLE DERIVATIVES, THEIR PREPARATION AND THEIR USE FOR MEDICAMENTS Dr. Karl Thomae GmbH (DE) 1982-10-13 EP disclosed
US-4343811-A ATHEROSCLEROSIS BOEHRINGER INGELHEIM GMBH (DE) 1982-08-10 US disclosed
EP-0015523-A1 Indole derivatives, their preparation and their use for medicaments Dr. Karl Thomae GmbH (DE) 1980-09-17 EP disclosed