SCHEMBL6010447

SCHEMBL6010447

CC(C)Oc1ccccc1-c1ccc(C=O)o1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 11/20 0.52
KDM4E B2RXH2 10/20 0.52
SLC9A1 P19634 1/20 0.52
POLB P06746 5/20 0.50
LMNA P02545 4/20 0.50
MAPT P10636 7/20 0.47
HPGD P15428 5/20 0.46
SMN1; SMN2 Q16637 3/20 0.46
L3MBTL1 Q9Y468 2/20 0.46
MEN1 O00255 5/20 0.44
KMT2A Q03164 5/20 0.44
RECQL P46063 4/20 0.44
PKM P14618 4/20 0.44
GLA P06280 2/20 0.44
GAA P10253 2/20 0.44
HTT P42858 2/20 0.44
PIK3CG P48736 1/20 0.41
CYP2C9 P11712 2/20 0.40
CYP2C19 P33261 2/20 0.40
HSD17B10 Q99714 1/20 0.40

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
SCHEMBL2551317 0.83 KDM4E (0.66) ALDH1A1KDM4ESLC9A1POLBLMNA
SCHEMBL6009509 0.80 SLC9A1 (0.56) ALDH1A1KDM4ESLC9A1POLBLMNA
SCHEMBL6009527 0.79 ALDH1A1 (0.59) ALDH1A1KDM4ESLC9A1POLBLMNA
SCHEMBL3038784 0.77 KDM4E (0.55) ALDH1A1KDM4ESLC9A1POLBLMNA
SCHEMBL6010443 0.76 SLC9A1 (0.52) ALDH1A1KDM4ESLC9A1POLBLMNA
SCHEMBL3634969 0.76 ALDH1A1 (0.68) ALDH1A1KDM4EPOLBLMNAMAPT
SCHEMBL2321506 0.74 KDM4E (0.58) ALDH1A1KDM4ESLC9A1POLBLMNA
SCHEMBL3039674 0.74 KDM4E (0.51) ALDH1A1KDM4EPOLBLMNAMAPT
SCHEMBL4943006 0.74 SLC9A1 (0.67) ALDH1A1KDM4ESLC9A1POLBMAPT
SCHEMBL2548634 0.73 KDM4E (0.52) ALDH1A1KDM4EPOLBLMNAMAPT

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-1697335-A1 FURANCARBONYLGUANIDINE DERIVATIVES, THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2006-09-06 EP disclosed
WO-2005063727-A1 FURANCARBONYLGUANIDINE DERIVATIVES, THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2005-07-14 WO disclosed