SCHEMBL6686708

SCHEMBL6686708

O=CC=CCc1cccc(Nc2ccccc2)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.47
ALDH1A1 P00352 3/20 0.47
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
AR P10275 1/20 0.47
TSHR P16473 2/20 0.41
TDP1 Q9NUW8 2/20 0.41
LMNA P02545 2/20 0.41
CYP3A4 P08684 2/20 0.41
GAA P10253 2/20 0.41
KDM4E B2RXH2 1/20 0.41
GFER P55789 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
MAOB P27338 1/20 0.39
HSD17B10 Q99714 4/20 0.39
FDFT1 P37268 1/20 0.39
MAPK1 P28482 2/20 0.38
ALOX15 P16050 1/20 0.38
ALOX12 P18054 1/20 0.38
PTGS1 P23219 1/20 0.38

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
SCHEMBL6832773 0.82 HDAC4 (0.33) MAPTMEN1KMT2AGAAMAOB
SCHEMBL6686285 0.82 APP (0.35) MAPTTSHRMAOBMAPK1HPGD
SCHEMBL6686837 0.82 CDC25B (0.50) MAPTALDH1A1MEN1KMT2ATSHR
SCHEMBL6686307 0.79 THRA (0.38) MAPTLMNACYP3A4MAPK1HPGD
SCHEMBL145089 0.78 MAOB (0.64) ALDH1A1MEN1KMT2ATDP1LMNA
SCHEMBL3132480 0.78 MAOB (0.64) ALDH1A1MEN1KMT2ATDP1LMNA
SCHEMBL12809833 0.78 MAOB (0.64) ALDH1A1MEN1KMT2ATDP1LMNA
SCHEMBL6683998 0.78 TDP1 (0.39) MAPTALDH1A1MEN1KMT2AAR
SCHEMBL28043124 0.78 AGXT (0.49) MAOBPTGS2CCNB2CDK1CDK4
Diphenylamine SCHEMBL27541752 0.74 HSD17B10 (0.46) MAPTALDH1A1MEN1KMT2AAR

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1472319-A1 NON-TOXIC CORROSION PROTECTION PIGMENTS BASED ON COBALT UNIVERSITY OF DAYTON (US) 2004-11-03 EP disclosed
WO-2004065305-A1 NON-TOXIC CORROSION-PROTECTION PIGMENTS BASED ON MANGANESE UNIVERSITY OF DAYTON (US) 2004-08-05 WO disclosed
WO-2003060019-A1 NON-TOXIC CORROSION PROTECTION PIGMENTS BASED ON COBALT UNIVERSITY OF DAYTON (US) 2003-07-24 WO disclosed