SCHEMBL8106430

SCHEMBL8106430

CCCCCCC(=O)c1c[c]ccc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B3 P37058 7/20 0.54
L3MBTL1 Q9Y468 2/20 0.50
MAPT P10636 2/20 0.50
LMNA P02545 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
CES2 O00748 2/20 0.49
CES1 P23141 2/20 0.49
MEN1 O00255 1/20 0.49
ALDH1A1 P00352 1/20 0.49
HTT P42858 1/20 0.49
KMT2A Q03164 1/20 0.49
ATM Q13315 1/20 0.49
HDAC3 O15379 1/20 0.46
HDAC4 P56524 1/20 0.46
HDAC1 Q13547 1/20 0.46
HDAC7 Q8WUI4 1/20 0.46
HDAC2 Q92769 1/20 0.46
HDAC10 Q969S8 1/20 0.46
HDAC11 Q96DB2 1/20 0.46
HDAC8 Q9BY41 1/20 0.46

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
SCHEMBL5548382 0.98 HSD17B3 (0.53) HSD17B3L3MBTL1MAPTLMNATDP1
SCHEMBL5547389 0.93 HSD17B3 (0.51) HSD17B3L3MBTL1MAPTLMNATDP1
SCHEMBL5542219 0.86 HPGD (0.49) HSD17B3L3MBTL1MAPTLMNATDP1
SCHEMBL28780268 0.80 L3MBTL1 (0.44) L3MBTL1MAPTLMNATDP1ALDH1A1
SCHEMBL9564629 0.80 HSD17B3 (0.66) HSD17B3L3MBTL1MAPTLMNATDP1
SCHEMBL9564653 0.80 HSD17B3 (0.66) HSD17B3L3MBTL1MAPTLMNATDP1
SCHEMBL9564630 0.80 HSD17B3 (0.66) HSD17B3L3MBTL1MAPTLMNATDP1
SCHEMBL4611644 0.80 HSD17B3 (0.66) HSD17B3L3MBTL1MAPTLMNATDP1
SCHEMBL9564617 0.80 HSD17B3 (0.66) HSD17B3L3MBTL1MAPTLMNATDP1
SCHEMBL9564644 0.80 HSD17B3 (0.66) HSD17B3L3MBTL1MAPTLMNATDP1

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
EP-0632031-B1 CONDENSED BENZOXA RING COMPOUND, PRODUCTION THEREOF, AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME TEIJIN LTD (JP) 2000-05-03 EP disclosed
US-5574061-A ANTILIPEMIC AGENT, ANTIATHEROSCLEROSIS, ACAT INHIBITOR TEIJIN LIMITED (JP) 1996-11-12 US disclosed
US-5496853-A FOR TREATING HYPERCHOLESTEROLEMIA TEIJIN LIMITED (JP) 1996-03-05 US disclosed
EP-0632031-A1 CONDENSED BENZOXA RING COMPOUND, PRODUCTION THEREOF, AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME TEIJIN LIMITED (JP) 1995-01-04 EP disclosed
EP-0546177-A1 BENZOPYRAN DERIVATIVE, PRODUCTION THEREOF, AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME TEIJIN LIMITED (JP) 1993-06-16 EP disclosed