SCHEMBL7129229

SCHEMBL7129229

Oc1ccc(-c2cccc(O)c2)cc1.Oc1cccc(-c2cccc(O)c2)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HSD17B1 P14061 10/20 1.00
HSD17B2 P37059 10/20 1.00
CYP3A4 P08684 3/20 0.90
CYP2C9 P11712 3/20 0.90
ESR1 P03372 6/20 0.80
MEN1 O00255 1/20 0.80
KMT2A Q03164 1/20 0.80
ABL1 P00519 2/20 0.74
ABCB1 P08183 2/20 0.74
BCR P11274 2/20 0.74
ESR2 Q92731 6/20 0.71
CYP1A2 P05177 1/20 0.71
CYP2D6 P10635 1/20 0.71
CYP2B6 P20813 1/20 0.71
CYP2C19 P33261 1/20 0.71
MMP3 P08254 1/20 0.62
BCL2L1 Q07817 1/20 0.62

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
SCHEMBL70625 1.00 HSD17B1 (1.00) HSD17B1HSD17B2CYP3A4CYP2C9ESR1
SCHEMBL29404406 1.00 HSD17B1 (1.00) HSD17B1HSD17B2CYP3A4CYP2C9ESR1
SCHEMBL1180998 1.00 HSD17B1 (1.00) HSD17B1HSD17B2CYP3A4CYP2C9ESR1
SCHEMBL1179866 0.97 HSD17B1 (0.95) HSD17B1HSD17B2CYP3A4CYP2C9ESR1
Bromide SCHEMBL30870493 0.97 HSD17B1 (0.95) HSD17B1HSD17B2CYP3A4CYP2C9ESR1
Hydrogen Sulfide SCHEMBL23879303 0.97 HSD17B1 (0.95) HSD17B1HSD17B2CYP3A4CYP2C9ESR1
SCHEMBL4399187 0.95 HSD17B1 (0.91) HSD17B1HSD17B2CYP3A4CYP2C9ESR1
SCHEMBL7898375 0.95 HSD17B1 (1.00) HSD17B1HSD17B2CYP3A4CYP2C9ESR1
Formaldehyde SCHEMBL28913385 0.93 HSD17B1 (0.86) HSD17B1HSD17B2CYP3A4CYP2C9ESR1
SCHEMBL8050006 0.92 HSD17B1 (0.94) HSD17B1HSD17B2CYP3A4CYP2C9ESR1

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
US-6664341-B2 Suppresses blistering during soldering; heat resistance; moldability KABUSHIKI KAISHA UENO SEIYAKU OYO KENKYUSHO (JP) 2003-12-16 US disclosed
US-20020190239-A1 Liquid-crystal polyester resin composition UENO FINE CHEMICALS INDUSTRY, LTD. (JP) 2002-12-19 US disclosed
EP-1195408-A1 LIQUID-CRYSTAL POLYESTER RESIN COMPOSITION KABUSHIKI KAISHA UENO SEIYAKU OYO KENKYUSHO (JP) 2002-04-10 EP disclosed