SCHEMBL6645548

SCHEMBL6645548

CC(C)(C)C1Sc2ccc(-c3ccco3)cc2C1(C)C

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PSMD14 O00487 1/20 0.38
TDP2 O95551 2/20 0.38
SRD5A1 P18405 1/20 0.37
LPL P06858 1/20 0.37
LIPG Q9Y5X9 1/20 0.37
TOP1 P11387 1/20 0.35
PGR P06401 1/20 0.35
TAAR1 Q96RJ0 1/20 0.34
ALDH1A1 P00352 2/20 0.34
KDM4E B2RXH2 1/20 0.34
MEN1 O00255 1/20 0.34
POLB P06746 1/20 0.34
TSHR P16473 1/20 0.34
KMT2A Q03164 1/20 0.34
HTR7 P34969 1/20 0.34
PRMT6 Q96LA8 1/20 0.33
ERN1 O75460 1/20 0.33
RECQL P46063 2/20 0.33
HSD17B10 Q99714 2/20 0.33
TDP1 Q9NUW8 2/20 0.33

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
SCHEMBL6644437 0.72 LPL (0.38) TDP2SRD5A1LPLLIPGTOP1
SCHEMBL6586181 0.70
SCHEMBL16166770 0.65 TAAR1 (0.48) PSMD14TDP2LPLLIPGTOP1
SCHEMBL21534752 0.63 TDP2 (0.46) TDP2LPLLIPGPGRTAAR1
SCHEMBL21868406 0.63 PRMT6 (0.36) TDP2SRD5A1LPLLIPGTOP1
SCHEMBL9511306 0.62 TAAR1 (0.46) PSMD14TDP2LPLLIPGTOP1
SCHEMBL16482595 0.61 LPL (0.40) TDP2SRD5A1LPLLIPGPGR
SCHEMBL19354601 0.61 TAAR1 (0.44) PSMD14TDP2LPLLIPGPGR
SCHEMBL394300 0.61 TAAR1 (0.76) LPLLIPGPGRTAAR1ALDH1A1
SCHEMBL8349771 0.60 PTGS1 (0.45) TDP2SRD5A1LPLLIPGTOP1

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-0883616-B1 DIHYDROBENZOFURAN AND RELATED COMPOUNDS USEFUL AS ANTI-INFLAMMATORY AGENTS UNIV VANDERBILT (US) 2004-08-25 EP disclosed