SCHEMBL8340370

SCHEMBL8340370

COc1c(Br)cc(Cl)cc1C(=O)Nc1ccc(Cl)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.56
MAPT P10636 4/20 0.56
SMN1; SMN2 Q16637 3/20 0.56
MEN1 O00255 3/20 0.56
KDM4E B2RXH2 2/20 0.56
F10 P00742 2/20 0.55
ALDH1A1 P00352 4/20 0.54
HDAC8 Q9BY41 2/20 0.54
P2RX1 P51575 2/20 0.52
NPC1 O15118 3/20 0.50
GAA P10253 2/20 0.50
POLB P06746 2/20 0.50
NLRP3 Q96P20 1/20 0.50
KCNMA1 Q12791 1/20 0.50
LMNA P02545 1/20 0.50
RAB9A P51151 1/20 0.50
HTT P42858 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49
TMPRSS4 Q9NRS4 1/20 0.48
AHR P35869 1/20 0.48

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
SCHEMBL25350384 0.83 ABCB1 (0.63) KMT2AMAPTSMN1; SMN2MEN1KDM4E
SCHEMBL13561040 0.82 SMN1; SMN2 (0.68) KMT2AMAPTSMN1; SMN2MEN1KDM4E
SCHEMBL9929102 0.79 HSD17B10 (0.50) KMT2AMAPTSMN1; SMN2MEN1KDM4E
SCHEMBL17740365 0.78 SMN1; SMN2 (0.70) KMT2AMAPTSMN1; SMN2MEN1KDM4E
SCHEMBL4129252 0.77 HSD17B10 (0.49) MAPTKDM4EALDH1A1GAAPOLB
SCHEMBL30810251 0.77 HSD17B10 (0.49) MAPTKDM4EALDH1A1GAAPOLB
SCHEMBL24118879 0.76 HSPD1 (0.69) KMT2AMAPTMEN1KDM4EHDAC8
SCHEMBL6591408 0.76 ALDH1A1 (0.63) KMT2AMAPTMEN1KDM4EF10
SCHEMBL24118867 0.76 HSPD1 (0.65) KMT2AMAPTSMN1; SMN2MEN1KDM4E
SCHEMBL30810187 0.76 HSD17B10 (0.69) KDM4EALDH1A1HTTHPGDHSD17B10

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
JP-11209328-A None JP disclosed
JP-H11209328-A ANILINE DERIVATIVE YAMANOUCHI PHARMACEUT CO LTD 1999-08-03 JP disclosed