SCHEMBL27915083

SCHEMBL27915083

CCc1cc(CCl)cc(C(N)=O)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXRA P19793 1/20 0.41
RXRB P28702 1/20 0.41
TSHR P16473 1/20 0.41
LMNA P02545 2/20 0.39
HTT P42858 2/20 0.39
PTGS2 P35354 2/20 0.37
PTGS1 P23219 1/20 0.37
MEN1 O00255 1/20 0.36
GAA P10253 1/20 0.36
KMT2A Q03164 1/20 0.36
ALDH1A1 P00352 1/20 0.35
PARP10 Q53GL7 1/20 0.35
SMN1; SMN2 Q16637 3/20 0.35
MAPT P10636 1/20 0.35
KDM4E B2RXH2 1/20 0.35
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
NCOA1 Q15788 1/20 0.34
NCOA3 Q9Y6Q9 1/20 0.34
BPTF Q12830 1/20 0.34

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
SCHEMBL1004651 0.90 RXRA (0.47) RXRARXRBTSHRLMNAHTT
SCHEMBL7902893 0.86 TSHR (0.47) RXRARXRBTSHRLMNAHTT
SCHEMBL17382019 0.81 ADRA1D (0.49) RXRARXRBTSHRLMNAHTT
SCHEMBL13870393 0.81 RXRA (0.41) RXRARXRBTSHRLMNAHTT
SCHEMBL4515297 0.78 PARP10 (0.47) RXRARXRBTSHRLMNAHTT
SCHEMBL608037 0.78 PTGS2 (0.39) RXRARXRBTSHRPTGS2GAA
SCHEMBL22096779 0.77 TSHR (0.41) RXRARXRBTSHRLMNAHTT
SCHEMBL9970966 0.77 PARP1 (0.46) RXRARXRBTSHRLMNAHTT
SCHEMBL27915060 0.76 CHEK2 (0.45) LMNAGAAALDH1A1MAPTKDM4E
SCHEMBL12075502 0.75 GPR84 (0.41) RXRARXRBTSHRPTGS2PTGS1

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
CN-103261156-A New compounds for the treatment of neurodegenerative diseases LEUVEN K U RES & DEV 2013-08-21 CN disclosed