SCHEMBL28129554

SCHEMBL28129554

Cc1ccc(C(=O)Pc2ccccc2)c(C)c1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NFE2L2 Q16236 1/20 0.50
HSD11B1 P28845 1/20 0.48
KMT2A Q03164 2/20 0.45
SMN1; SMN2 Q16637 3/20 0.44
NPC1 O15118 2/20 0.44
RAB9A P51151 2/20 0.44
MEN1 O00255 1/20 0.43
AVPR2 P30518 1/20 0.41
GPR27 Q9NS67 1/20 0.41
HDAC7 Q8WUI4 1/20 0.41
CES2 O00748 1/20 0.40
CES1 P23141 1/20 0.40
POLB P06746 1/20 0.39
HTT P42858 1/20 0.39
AKR1C3 P42330 1/20 0.39

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
SCHEMBL28226766 0.82 CES2 (0.42) NFE2L2KMT2ASMN1; SMN2NPC1RAB9A
SCHEMBL98044 0.79 LMNA (0.38) NFE2L2KMT2ASMN1; SMN2MEN1
Water SCHEMBL27753202 0.77 LMNA (0.37) NFE2L2KMT2ASMN1; SMN2MEN1
SCHEMBL7177452 0.77 LMNA (0.37) NFE2L2KMT2ASMN1; SMN2MEN1
SCHEMBL4583573 0.77 MEN1 (0.36) NFE2L2KMT2AMEN1CES2CES1
Lithium SCHEMBL30019571 0.77 LMNA (0.37) NFE2L2KMT2ASMN1; SMN2MEN1
SCHEMBL12002961 0.77 LMNA (0.37) NFE2L2KMT2ASMN1; SMN2MEN1
SCHEMBL30957831 0.77 CRHR1 (0.39) HSD11B1KMT2ASMN1; SMN2MEN1
Hydrochloric Acid SCHEMBL30768081 0.77 LMNA (0.37) NFE2L2KMT2ASMN1; SMN2MEN1
Acetic Acid SCHEMBL30431333 0.76 LMNA (0.36) NFE2L2KMT2ASMN1; SMN2MEN1

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
CN-106457908-B The flat reinforcement of MULTIPLE COMPOSITE 米其林集团总公司 2018-06-05 CN disclosed
CN-106457908-A Multi-composite planar reinforcement 米其林集团总公司 2017-02-22 CN disclosed