SCHEMBL9901928

SCHEMBL9901928

CC(Cc1c(O)cccc1O)=NO

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.37
POLB P06746 2/20 0.36
ALDH1A1 P00352 4/20 0.35
CA2 P00918 3/20 0.35
LMNA P02545 3/20 0.35
HPGD P15428 3/20 0.35
ALOX15 P16050 3/20 0.35
HSD17B10 Q99714 3/20 0.35
EGFR P00533 2/20 0.35
FYN P06241 2/20 0.35
MMP9 P14780 2/20 0.35
RECQL P46063 2/20 0.35
TDP1 Q9NUW8 2/20 0.35
CA1 P00915 2/20 0.35
ADAMTS4 O75173 1/20 0.35
MMP2 P08253 1/20 0.35
MMP8 P22894 1/20 0.35
CA6 P23280 1/20 0.35
CDK2 P24941 1/20 0.35
MMP12 P39900 1/20 0.35

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
SCHEMBL8772705 0.77 AKR1B1 (0.52) POLBCA2CA12HIF1ACA9
SCHEMBL9900443 0.74 THRB (0.38) THRBALDH1A1CA2LMNACA1
SCHEMBL7882828 0.73 THRB (0.50) THRBALDH1A1CA2LMNAHPGD
SCHEMBL7962013 0.70 GAA (0.50) POLBALDH1A1NPC1KMT2AKDM4E
SCHEMBL3658960 0.68 CTBP2 (0.52) POLBALDH1A1MEN1KMT2AKDM4E
SCHEMBL10177334 0.68 CTBP2 (0.52) POLBALDH1A1MEN1KMT2AKDM4E
SCHEMBL14667472 0.68 CTBP2 (0.52) POLBALDH1A1MEN1KMT2AKDM4E
SCHEMBL28715269 0.67 AKR1B1 (0.44) THRBPOLBALDH1A1CA2LMNA
SCHEMBL28007823 0.67 CTBP2 (0.52) ALDH1A1CA2LMNASMN1; SMN2GAA
SCHEMBL68691 0.66 GABRA1 (0.48) THRBPOLBALDH1A1CA2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2649066-A1 HYDANTOIN DERIVATIVES USEFUL AS KV3 INHIBITORS Autifony Therapeutics Limited (GB) 2013-10-16 EP disclosed
WO-2012076877-A1 HYDANTOIN DERIVATIVES USEFUL AS KV3 INHIBITORS AUTIFONY THERAPEUTICS LIMITED (GB) 2012-06-14 WO disclosed