SCHEMBL9754835

SCHEMBL9754835

COC(=O)Oc1ccccc1-c1ccc(C)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.51
HPGD P15428 1/20 0.51
HSD17B10 Q99714 1/20 0.51
LMNA P02545 4/20 0.49
TDP1 Q9NUW8 2/20 0.49
MAPK1 P28482 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
ALDH1A1 P00352 3/20 0.47
HTT P42858 2/20 0.47
SLC6A4 P31645 2/20 0.44
SLC6A3 Q01959 2/20 0.44
SYK P43405 1/20 0.43
RAB9A P51151 3/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
GLA P06280 1/20 0.43
PAX8 Q06710 1/20 0.43
FABP3 P05413 2/20 0.42
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
POLB P06746 1/20 0.41

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
SCHEMBL1834873 0.88 KDM4E (0.61) KDM4EHPGDHSD17B10LMNATDP1
SCHEMBL15555970 0.85 SLC6A3 (0.56) KDM4EHPGDHSD17B10LMNATDP1
SCHEMBL28530771 0.85 SLC6A4 (0.58) KDM4EHPGDHSD17B10LMNASLC6A4
SCHEMBL6254697 0.84 KDM4E (0.63) KDM4EHPGDHSD17B10LMNATDP1
SCHEMBL6447567 0.83 LMNA (0.55) KDM4ELMNATDP1MAPK1L3MBTL1
SCHEMBL709954 0.83 LMNA (0.51) KDM4ELMNATDP1MAPK1L3MBTL1
SCHEMBL867780 0.83 MAOB (0.52) KDM4EHPGDHSD17B10LMNATDP1
SCHEMBL6447472 0.83 LMNA (0.46) KDM4EHPGDLMNATDP1MAPK1
SCHEMBL17066644 0.82 BCHE (0.49) LMNAALDH1A1RAB9ASMN1; SMN2MEN1
SCHEMBL6950322 0.81 KDM4E (0.46) KDM4EHPGDHSD17B10LMNAMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1991013063-A1 NEW BENZIMIDAZOLE DERIVATIVES, METHOD FOR PREPARING THEM AND THEIR PHARMACEUTICAL USE SCHERING AKTIENGESELLSCHAFT BERLIN UND BERGKAMEN (DE) 1991-09-05 WO disclosed