SCHEMBL27600883

SCHEMBL27600883

COCOc1cc(CC(OCc2ccccc2)C(=O)O)cnn1

nearest known ligand 0.45

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 14/20 0.45
PPARG P37231 14/20 0.45
PPARD Q03181 3/20 0.45
FFAR1 O14842 1/20 0.40
SRR Q9GZT4 2/20 0.39
PTGS2 P35354 1/20 0.37
GABRG2 P18507 1/20 0.37
GABRB3 P28472 1/20 0.37
GABRA5 P31644 1/20 0.37
GABRA3 P34903 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
SCHEMBL27600882 0.74 PSMB5 (0.41) PPARAPPARGPTGS2
SCHEMBL6429518 0.73 SRR (0.65) PPARAPPARGPPARDSRR
SCHEMBL3781159 0.73 SRR (0.65) PPARAPPARGPPARDSRR
SCHEMBL10798806 0.73 SRR (0.65) PPARAPPARGPPARDSRR
SCHEMBL27696462 0.72 SRR (0.59) PPARAPPARGPPARDSRR
SCHEMBL5213182 0.69 PTGIR (0.42) PPARAPPARGPPARD
SCHEMBL28941504 0.67 TDP1 (0.33)
SCHEMBL15528161 0.66 SLC1A3 (0.53) PPARAPPARGPPARDSRR
SCHEMBL1670312 0.66 PPARA (0.69) PPARAPPARGPPARDSRR
SCHEMBL2384187 0.66 SLC1A3 (0.53) PPARAPPARGPPARDSRR

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
CN-100357280-C Dihydronaphthalene devivatives and drugs contanining these compounds as active ingrdeient ONO PHARMACENTICAL CO LTD (JP) 2007-12-26 CN disclosed
CN-1489582-A Dihydronaphthalene devivatives and drugs contanining these compounds as active ingrdeient СҰҩƷ��ҵ��ʽ���� 2004-04-14 CN disclosed