SCHEMBL7909295

SCHEMBL7909295

C=C(C)c1ccc(O)cc1CC

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B1 P14061 1/20 0.51
HSP90AB1 P08238 1/20 0.44
CA12 O43570 4/20 0.41
CA1 P00915 4/20 0.41
CA2 P00918 4/20 0.41
CA7 P43166 4/20 0.41
CA9 Q16790 4/20 0.41
CA14 Q9ULX7 4/20 0.41
HTT P42858 1/20 0.39
HSD17B3 P37058 1/20 0.39
CES2 O00748 1/20 0.38
KDM4E B2RXH2 1/20 0.37
ALDH1A1 P00352 2/20 0.36
TSHR P16473 1/20 0.36
TYR P14679 1/20 0.36
GFER P55789 1/20 0.36
PDK2 Q15119 1/20 0.36
PDK4 Q16654 1/20 0.36
ESRRB O95718 1/20 0.36
ESR1 P03372 1/20 0.36

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
SCHEMBL7910282 0.85 TYR (0.42) HSD17B1HSP90AB1CA12CA1CA2
SCHEMBL16311335 0.84 HSD17B1 (0.43) HSD17B1HSP90AB1CA12CA1CA2
SCHEMBL13760574 0.83 HSP90AB1 (0.41) HSD17B1HSP90AB1CA12CA1CA2
SCHEMBL7902094 0.82 TYR (0.56) HTTKDM4EALDH1A1TSHRTYR
SCHEMBL29483331 0.82 HSD17B1 (0.41) HSD17B1HSP90AB1HTTALDH1A1GABRA1
SCHEMBL20262941 0.82 HSD17B1 (0.41) HSD17B1HSP90AB1HTTALDH1A1GABRA1
SCHEMBL8271835 0.82 HSD17B1 (0.73) HSD17B1HSP90AB1CA12CA1CA2
SCHEMBL27005987 0.80 HSD17B1 (0.40) HSD17B1HTT
SCHEMBL1363368 0.80 TRPA1 (0.42) HSD17B1HTTKDM4EALDH1A1TSHR
SCHEMBL1081179 0.79 GABRA1 (0.42) HSD17B1HSP90AB1KDM4EALDH1A1ESR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10766992-B2 Resin and resist composition SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2020-09-08 US disclosed
EP-2906529-B9 A NEW PRODUCTION METHOD AND NEW INTERMEDIATES OF SYNTHESIS OF ELVITEGRAVIR ZENTIVA KS (CZ) 2017-03-15 EP disclosed
US-9051405-B2 Resin and resist composition SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2015-06-09 US disclosed
US-9051405-B2 Resin and resist composition SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2015-06-09 US disclosed
US-20150132698-A1 RESIN AND RESIST COMPOSITION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2015-05-14 US disclosed
US-20150132698-A1 RESIN AND RESIST COMPOSITION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2015-05-14 US disclosed
US-20100323296-A1 RESIN AND RESIST COMPOSITION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-12-23 US disclosed
US-20100323296-A1 RESIN AND RESIST COMPOSITION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-12-23 US disclosed
US-6211328-B1 IN PRESENCE OF AN ACID GUN EI CHEMICAL INDUSTRY CO., LTD (JP) 2001-04-03 US disclosed