SCHEMBL17827115

SCHEMBL17827115

CCOC(=O)[C@H]1CCC=C1C

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.46
MEN1 O00255 3/20 0.46
KMT2A Q03164 3/20 0.46
ALDH1A1 P00352 3/20 0.46
KDM4E B2RXH2 2/20 0.46
GAA P10253 2/20 0.46
HSD17B10 Q99714 2/20 0.46
HPGD P15428 1/20 0.46
TLR4 O00206 1/20 0.42
CHRM2 P08172 1/20 0.39
CHRM4 P08173 1/20 0.39
CHRM5 P08912 1/20 0.39
CHRM1 P11229 1/20 0.39
CHRM3 P20309 1/20 0.39
RECQL P46063 1/20 0.38
PPM1B O75688 1/20 0.38
PTPN1 P18031 1/20 0.38
PPP1CC P36873 1/20 0.38
RAB9A P51151 1/20 0.38
TSHR P16473 1/20 0.37

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
SCHEMBL1196448 0.85 ALDH1A1 (0.41) MAPTMEN1KMT2AALDH1A1KDM4E
SCHEMBL28369299 0.81 MAPT (0.43) MAPTMEN1KMT2AALDH1A1KDM4E
SCHEMBL17036679 0.80 MEN1 (0.42) MAPTMEN1KMT2AALDH1A1KDM4E
SCHEMBL819340 0.76 TLR4 (0.39) MAPTMEN1KMT2AALDH1A1KDM4E
SCHEMBL22855358 0.75 ALDH1A1 (0.44) MAPTMEN1KMT2AALDH1A1KDM4E
SCHEMBL1783162 0.74
SCHEMBL24249958 0.74 TLR4 (0.49) MAPTMEN1KMT2AALDH1A1KDM4E
SCHEMBL1141761 0.74 TLR4 (0.49) MAPTMEN1KMT2AALDH1A1KDM4E
SCHEMBL17118109 0.74 TLR4 (0.49) MAPTMEN1KMT2AALDH1A1KDM4E
SCHEMBL19552512 0.74 ALDH1A1 (0.46) MAPTMEN1KMT2AALDH1A1KDM4E

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
EP-3031324-A2 TRICYCLIC KINASE INHIBITORS AbbVie Inc. (US) 2016-06-15 EP disclosed