SCHEMBL14445783

SCHEMBL14445783

COC(=O)C(C)c1oc(-c2ccccc2)nc1C

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 1/20 0.51
▸ ALDH1A1 P00352 4/20 0.45
▸ KDM4E B2RXH2 4/20 0.45
▸ HSD17B10 Q99714 3/20 0.45
▸ HPGD P15428 2/20 0.45
▸ TARBP2 Q15633 2/20 0.44
▸ LMNA P02545 1/20 0.43
▸ KMT2A Q03164 1/20 0.42
▸ MAPT P10636 1/20 0.42
▸ ALOX15 P16050 1/20 0.42
▸ IKBKB O14920 1/20 0.41
▸ TSHR P16473 1/20 0.41
▸ POLB P06746 2/20 0.40
▸ TOP2A P11388 1/20 0.40
▸ NPC1 O15118 1/20 0.40
▸ RAB9A P51151 1/20 0.40
▸ MAPK1 P28482 1/20 0.40
▸ VDR P11473 1/20 0.40
▸ PPARG P37231 1/20 0.40
▸ PPARA Q07869 1/20 0.40

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
SCHEMBL13721722 0.81 TARBP2 (0.50) GAAALDH1A1KDM4EHSD17B10HPGD
SCHEMBL1984902 0.77 GAA (0.49) GAAALDH1A1KDM4EHSD17B10HPGD
SCHEMBL12270194 0.77 GAA (0.47) GAAALDH1A1KDM4EHPGDMAPT
SCHEMBL2778196 0.74 ALDH1A1 (0.74) GAAALDH1A1KDM4EHSD17B10HPGD
SCHEMBL1981913 0.73 GAA (0.49) GAAALDH1A1KDM4EHSD17B10HPGD
SCHEMBL14504405 0.73 KDM4E (0.63) GAAALDH1A1KDM4EHSD17B10HPGD
SCHEMBL20646881 0.71 GAA (0.64) GAAALDH1A1KDM4EHSD17B10HPGD
SCHEMBL2789941 0.71 GAA (0.73) GAAALDH1A1KDM4EHSD17B10HPGD
SCHEMBL4425538 0.70 PPARD (0.53) GAAALDH1A1KDM4EHSD17B10HPGD
SCHEMBL6912084 0.70 KDM4E (0.60) KDM4EHPGDTARBP2LMNAPPARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7241780-B2 Substituted acid derivatives useful as antidiabetic and antiobesity agents and method BRISTOLS-MYERS SQUIBB COMPANY (US) 2007-07-10 — — US disclosed
US-7241780-B2 Substituted acid derivatives useful as antidiabetic and antiobesity agents and method BRISTOLS-MYERS SQUIBB COMPANY (US) 2007-07-10 — — US disclosed
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