SCHEMBL879436

SCHEMBL879436

NC(S)C(=O)NC1CCCCC1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 8/20 0.54
NPC1 O15118 4/20 0.54
SMN1; SMN2 Q16637 4/20 0.54
RAB9A P51151 3/20 0.54
MAPT P10636 1/20 0.54
KDM4E B2RXH2 1/20 0.54
ALDH1A1 P00352 1/20 0.54
CYP3A4 P08684 1/20 0.54
EPHX2 P34913 1/20 0.54
ATM Q13315 1/20 0.46
MMP2 P08253 3/20 0.45
CA12 O43570 2/20 0.45
CA1 P00915 2/20 0.45
CA2 P00918 2/20 0.45
CA9 Q16790 2/20 0.45
MMP8 P22894 1/20 0.45
MMP1 P03956 1/20 0.45
MMP3 P08254 1/20 0.45
MAPK1 P28482 1/20 0.45
DUSP3 P51452 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
SCHEMBL1679986 0.84 EPHX1 (0.56) EPHX1NPC1SMN1; SMN2RAB9AMAPT
SCHEMBL4964520 0.82 EPHX1 (0.52) EPHX1NPC1SMN1; SMN2RAB9AMAPT
SCHEMBL22546809 0.81 ATM (0.53) EPHX1NPC1SMN1; SMN2RAB9AMAPT
SCHEMBL22546765 0.81 ATM (0.53) EPHX1NPC1SMN1; SMN2RAB9AMAPT
SCHEMBL22546666 0.81 ATM (0.53) EPHX1NPC1SMN1; SMN2RAB9AMAPT
SCHEMBL24213834 0.81 ATM (0.53) EPHX1NPC1SMN1; SMN2RAB9AMAPT
SCHEMBL22679468 0.81 EPHX1 (0.52) EPHX1NPC1SMN1; SMN2RAB9AMAPT
SCHEMBL24213833 0.81 ATM (0.53) EPHX1NPC1SMN1; SMN2RAB9AMAPT
SCHEMBL24323695 0.81 ATM (0.53) EPHX1NPC1SMN1; SMN2RAB9AMAPT
SCHEMBL5220264 0.81 ATM (0.53) EPHX1NPC1SMN1; SMN2RAB9AMAPT

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
EP-2434343-A1 Resist composition, resist film therefrom and method of forming pattern therewith Fujifilm Corporation (JP) 2012-03-28 EP disclosed