SCHEMBL7471000

SCHEMBL7471000

Cc1nc(-c2cccc(NC(=O)c3cccc(-c4cccs4)c3)c2)[nH]c1C

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 6/20 0.48
KMT2A Q03164 6/20 0.48
COMT P21964 2/20 0.48
MMP2 P08253 1/20 0.48
MMP9 P14780 1/20 0.48
MMP8 P22894 1/20 0.48
MMP13 P45452 1/20 0.48
BRD4 O60885 1/20 0.48
MAPT P10636 6/20 0.47
KDM4E B2RXH2 2/20 0.47
POLB P06746 2/20 0.47
RECQL P46063 2/20 0.47
NPC1 O15118 2/20 0.47
RAB9A P51151 2/20 0.47
THRB P10828 1/20 0.47
ATM Q13315 1/20 0.47
KCNK3 O14649 1/20 0.46
KCNK9 Q9NPC2 1/20 0.46
HCK P08631 1/20 0.45
NR2C2 P49116 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
SCHEMBL6759857 0.76 ABL1 (0.56) MEN1KMT2AKCNK3KCNK9HCK
SCHEMBL6834840 0.75 FYN (0.51) MEN1KMT2AMAPTKCNK3KCNK9
SCHEMBL6803237 0.74 CSF1R (0.44) MEN1KMT2AMAPTPOLBKCNK3
SCHEMBL7984140 0.74 ALDH1A1 (0.58) MEN1KMT2ACOMTMMP2MMP9
SCHEMBL6759881 0.73 EPHA2 (0.49) MEN1KMT2AMAPTKCNK3KCNK9
SCHEMBL27519956 0.73 HCK (0.48) MEN1KMT2AMAPTPOLBKCNK3
SCHEMBL592446 0.71 NQO2 (0.66) MEN1KMT2AMAPTKDM4ENPC1
SCHEMBL7979817 0.70 CYP1A2 (0.51) MEN1KMT2ACOMTMMP2MMP9
SCHEMBL27824615 0.70 MAPT (0.47) MEN1KMT2AMAPTKDM4EPOLB
SCHEMBL6756711 0.70 FYN (0.48) HCKNR2C2BTKHTR1AADORA3

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
EP-1216240-A1 AMIDE COMPOUNDS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-06-26 EP disclosed
WO-2001025229-A1 AMIDE COMPOUNDS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2001-04-12 WO disclosed