SCHEMBL4915411

SCHEMBL4915411

[CH2]COCCC1CCCCC1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NFE2L2 Q16236 1/20 0.40
CYP1A2 P05177 1/20 0.39
SIGMAR1 Q99720 3/20 0.37
HPGD P15428 3/20 0.34
KDM4E B2RXH2 1/20 0.34
MEN1 O00255 1/20 0.34
USP2 O75604 1/20 0.34
ALDH1A1 P00352 1/20 0.34
LMNA P02545 1/20 0.34
MAPT P10636 1/20 0.34
ALOX15 P16050 1/20 0.34
ALOX12 P18054 1/20 0.34
BRCA1 P38398 1/20 0.34
HTT P42858 1/20 0.34
RECQL P46063 1/20 0.34
KMT2A Q03164 1/20 0.34
HSD17B10 Q99714 1/20 0.34
EPHX1 P07099 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
SPHK2 Q9NRA0 4/20 0.32

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
SCHEMBL11254475 0.88 CYP1A2 (0.48) NFE2L2CYP1A2SIGMAR1HPGDEPHX1
SCHEMBL128307 0.87
SCHEMBL6610934 0.86 SIGMAR1 (0.48) CYP1A2SIGMAR1HPGDEPHX1SPHK2
SCHEMBL11224710 0.85 CYP1A2 (0.46) NFE2L2CYP1A2SIGMAR1HPGDKDM4E
SCHEMBL8743871 0.85 CYP1A2 (0.46) NFE2L2CYP1A2SIGMAR1HPGDKDM4E
SCHEMBL9864420 0.84 NFE2L2 (0.39) NFE2L2CYP1A2SIGMAR1HPGDKDM4E
SCHEMBL21938959 0.82 CYP1A2 (0.44) NFE2L2CYP1A2SIGMAR1HPGDKDM4E
SCHEMBL8986251 0.82 NFE2L2 (0.42) NFE2L2CYP1A2SIGMAR1HPGDKDM4E
SCHEMBL4497381 0.81 NFE2L2 (0.36) NFE2L2CYP1A2SIGMAR1EPHX1SMN1; SMN2
SCHEMBL20265993 0.78 SPHK1 (0.42) NFE2L2CYP1A2SIGMAR1HPGDKDM4E

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-20080076062-A1 RESIST COMPOSITION AND PATTERN-FORMING METHOD USING THE SAME FUJIFILM CORPORATION (JP) 2008-03-27 US disclosed