SCHEMBL11575468

SCHEMBL11575468

COc1cc(Cl)c(C(=O)c2ccccc2OC)cc1C

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 2/20 0.53
MAPK13 O15264 1/20 0.53
MAPK12 P53778 1/20 0.53
MAPK11 Q15759 1/20 0.53
POLB P06746 2/20 0.47
KMT2A Q03164 2/20 0.47
MEN1 O00255 1/20 0.47
LMNA P02545 4/20 0.47
ALOX15 P16050 1/20 0.47
HSD17B10 Q99714 1/20 0.47
RAB9A P51151 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
KCNK3 O14649 2/20 0.46
KCNK9 Q9NPC2 2/20 0.46
MAPT P10636 1/20 0.46
ABCB1 P08183 1/20 0.46
HPGD P15428 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
BCL2L11 O43521 1/20 0.45
BCL2L1 Q07817 1/20 0.45

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
SCHEMBL11574726 0.83 MAPK14 (0.49) MAPK14MAPK13MAPK12MAPK11POLB
SCHEMBL17770569 0.82 LMNA (0.60) MAPK14MAPK13MAPK12MAPK11POLB
SCHEMBL31186154 0.81 MAPK13 (0.60) MAPK14MAPK13MAPK12MAPK11KMT2A
SCHEMBL322168 0.81 CTSD (0.62) LMNAALOX15HSD17B10RAB9ASMN1; SMN2
SCHEMBL29658169 0.81 CTSD (0.62) LMNAALOX15HSD17B10RAB9ASMN1; SMN2
SCHEMBL3824758 0.81 RECQL (0.54) MAPK14MAPK13MAPK12MAPK11POLB
SCHEMBL11576124 0.80 MAPK13 (0.58) MAPK14MAPK13MAPK12MAPK11POLB
SCHEMBL9177911 0.80 KCNK3 (0.56) POLBKMT2ALMNAALOX15HSD17B10
SCHEMBL27789892 0.79 CTSD (0.60) LMNAALOX15HSD17B10RAB9ASMN1; SMN2
SCHEMBL11577125 0.79 MAPT (0.62) POLBKMT2AMEN1LMNARAB9A

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
US-4115413-A ACID FREE BAYER AKTIENGESELLSCHAFT (DE) 1978-09-19 US disclosed