SCHEMBL9683494

SCHEMBL9683494

Cc1ccc(-c2cc(O)ccc2C(=O)O)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.58
MCL1 Q07820 1/20 0.54
CA12 O43570 3/20 0.50
CA9 Q16790 3/20 0.50
ALDH1A1 P00352 2/20 0.50
CA1 P00915 2/20 0.50
CA2 P00918 2/20 0.50
CA7 P43166 2/20 0.50
CA14 Q9ULX7 2/20 0.50
TSHR P16473 1/20 0.50
MEN1 O00255 1/20 0.50
MAPT P10636 1/20 0.50
HTT P42858 1/20 0.50
KMT2A Q03164 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
AKR1C2 P52895 1/20 0.49
AKR1C1 Q04828 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.47
HSD17B1 P14061 1/20 0.47
CSNK2A1 P68400 1/20 0.47

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
SCHEMBL2785635 0.91 HSD17B10 (0.68) HSD17B10MCL1CA12CA9ALDH1A1
SCHEMBL9683573 0.89 HSD17B10 (0.58) HSD17B10MCL1CA12CA9ALDH1A1
SCHEMBL20695878 0.89 HSD17B10 (0.66) HSD17B10MCL1CA12CA9ALDH1A1
SCHEMBL900834 0.89 HSD17B10 (0.71) HSD17B10CA12CA9ALDH1A1CA1
SCHEMBL6498971 0.87 HDAC7 (0.57) HSD17B10MCL1ALDH1A1MEN1KMT2A
SCHEMBL10079022 0.86 HSD17B10 (0.79) HSD17B10MCL1CA12CA9ALDH1A1
SCHEMBL3040769 0.83 HSD17B10 (0.58) HSD17B10MCL1CA12CA9ALDH1A1
SCHEMBL9786887 0.83 HSD17B1 (0.66) HSD17B10CA12CA9ALDH1A1CA1
SCHEMBL5583149 0.83 HSD17B10 (0.54) HSD17B10MCL1CA12CA9ALDH1A1
SCHEMBL30832923 0.83 MCL1 (0.58) HSD17B10MCL1ALDH1A1KMT2AAKR1C2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5089590-A LIQUID CRYSTALLINE COMPOUNDS, THEIR PRODUCTION AND THEIR USE AS MODIFIERS FOR POLYCARBONATES, POLYESTER CARBONATES AND POLYESTERS BAYER AKTIENGESELLSCHAFT (DE) 1992-02-18 US disclosed
US-5084549-A Aromatic polyesters as thermoplastic molding materials BAYER AKTIENGESELLSCHAFT (DE) 1992-01-28 US disclosed
US-5043403-A Polycarbonates containing mesogenic compounds as end groups, their preparation and their use BAYER AKTIENGESELLSCHAFT (DE) 1991-08-27 US disclosed
EP-0354347-A2 Liquid crystal compounds,their manufacture as modifiers for polycarbonates,polyestercarbonates and polyesters BAYER AG (DE) 1990-02-14 EP disclosed
EP-0347682-A2 Polycarbonates with mesogenic compounds as end groups, their preparation and their use BAYER AG (DE) 1989-12-27 EP disclosed