SCHEMBL9033665

SCHEMBL9033665

CC(=CC(=O)O)c1ccc2c(ccn2Cc2cccc(C)c2)c1

nearest known ligand 0.63

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PLAU P00749 2/20 0.50
PLG P00747 1/20 0.50
HDAC3 O15379 2/20 0.47
HDAC1 Q13547 2/20 0.47
HDAC2 Q92769 2/20 0.47
HDAC8 Q9BY41 2/20 0.47
HDAC6 Q9UBN7 2/20 0.47
HDAC4 P56524 1/20 0.45
HDAC7 Q8WUI4 1/20 0.45
HDAC10 Q969S8 1/20 0.45
HDAC11 Q96DB2 1/20 0.45
HDAC9 Q9UKV0 1/20 0.45
HDAC5 Q9UQL6 1/20 0.45
PPARG P37231 1/20 0.44
SLC2A1 P11166 1/20 0.43

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
SCHEMBL9033656 1.00 PLAU (0.50) PLAUPLGHDAC3HDAC1HDAC2
SCHEMBL9032866 0.90 HDAC8 (0.52) PLAUPLGHDAC3HDAC1HDAC2
SCHEMBL9032886 0.90 HDAC8 (0.52) PLAUPLGHDAC3HDAC1HDAC2
SCHEMBL9034330 0.87 HDAC6 (0.60) PLAUPLGHDAC3HDAC1HDAC2
SCHEMBL9034319 0.87 HDAC6 (0.60) PLAUPLGHDAC3HDAC1HDAC2
SCHEMBL30185512 0.86 PLAU (0.56) PLAUPLGHDAC3HDAC1HDAC2
SCHEMBL28580033 0.86 PLAU (0.56) PLAUPLGHDAC3HDAC1HDAC2
SCHEMBL9033662 0.83 HDAC3 (0.44) PLAUPLGHDAC3HDAC1HDAC2
SCHEMBL9033003 0.82 HDAC8 (0.59) PLAUPLGHDAC3HDAC1HDAC2
SCHEMBL9033027 0.82 HDAC8 (0.59) PLAUPLGHDAC3HDAC1HDAC2

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
EP-0511477-B1 Indole derivatives KYOWA HAKKO KOGYO KK (JP) 1996-07-10 EP disclosed
US-5239083-A Anticarcinogenic agents, prostate cancer treatment KYOWA HAKKO KOGYO CO., LTD. (JP) 1993-08-24 US disclosed
EP-0511477-A1 Indole derivatives KYOWA HAKKO KOGYO CO., LTD. (JP) 1992-11-04 EP disclosed