SCHEMBL6989792

SCHEMBL6989792

O=C(c1ccnc(C(=O)N(CCc2ccccc2)CCc2ccccc2)c1)N(CCc1ccccc1)CCc1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.45
KMT2A Q03164 3/20 0.45
RAB9A P51151 2/20 0.45
TDP1 Q9NUW8 2/20 0.45
NPC1 O15118 1/20 0.45
KDM5B Q9UGL1 3/20 0.44
KDM4E B2RXH2 2/20 0.44
KDM5A P29375 2/20 0.44
KDM5C P41229 2/20 0.44
RCE1 Q9Y256 1/20 0.44
CA12 O43570 1/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
CA9 Q16790 1/20 0.43
MAPT P10636 3/20 0.42
ALDH1A1 P00352 2/20 0.42
KDM6B O15054 1/20 0.42
TET3 O43151 1/20 0.42
KDM4A O75164 1/20 0.42
BBOX1 O75936 1/20 0.42

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
SCHEMBL6985002 0.92 KDM4E (0.42) KDM5BKDM4EKDM5AKDM5CMAPT
SCHEMBL6235518 0.86 ALDH1A1 (0.49) RAB9ANPC1KDM5BKDM4EKDM5A
SCHEMBL6239726 0.86 ALDH1A1 (0.46) RAB9ANPC1KDM5BKDM4EKDM5A
SCHEMBL6985934 0.86 MAPT (0.43) RAB9ATDP1NPC1KDM5BKDM4E
SCHEMBL5210605 0.85 CFTR (0.55) MEN1KMT2ATDP1KDM5BKDM4E
SCHEMBL6985000 0.85 KDM4C (0.50) KDM5BKDM4EKDM5AKDM5CMAPT
SCHEMBL6990114 0.83 LPAR1 (0.49) MEN1KMT2ACA12CA1CA2
SCHEMBL6986949 0.82 SLC2A1 (0.48) LPAR1LPAR5
SCHEMBL6989317 0.81 SMN1; SMN2 (0.47) RAB9ANPC1CA1CA2CA9
SCHEMBL6235516 0.81 KDM4C (0.49) MEN1KMT2AKDM5BKDM4EKDM5A

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-1362033-A1 PYRIDINE MATRIX METALLOPROTEINASE INHIBITORS Warner-Lambert Company LLC (US) 2003-11-19 EP claimed
WO-2002064568-A1 PYRIDINE MATRIX METALLOPROTEINASE INHIBITORS WARNER-LAMBERT COMPANY LLC (US) 2002-08-22 WO claimed