SCHEMBL7994265

SCHEMBL7994265

CCCCN(CCCC)CCCNCCN(CC)CC

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PAOX Q6QHF9 1/20 0.50
ALDH1A1 P00352 3/20 0.44
TSHR P16473 2/20 0.44
KDM5A P29375 1/20 0.35
KDM4C Q9H3R0 1/20 0.35
KDM4E B2RXH2 1/20 0.35
HSD17B10 Q99714 1/20 0.35
TDP1 Q9NUW8 1/20 0.34
CHRM2 P08172 1/20 0.34
MEN1 O00255 1/20 0.33
LMNA P02545 1/20 0.33
KMT2A Q03164 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33

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
SCHEMBL7994712 0.91 PAOX (0.57) PAOXALDH1A1TSHRKDM4ETDP1
SCHEMBL8009387 0.89 TSHR (0.50) PAOXALDH1A1TSHRKDM5AKDM4C
SCHEMBL8345906 0.89 TSHR (0.50) PAOXALDH1A1TSHRKDM5AKDM4C
SCHEMBL10814957 0.89 TSHR (0.50) PAOXALDH1A1TSHRTDP1CHRM2
SCHEMBL1086951 0.89 TSHR (0.48) PAOXALDH1A1TSHRKDM5AKDM4C
SCHEMBL1087132 0.89 TSHR (0.55) PAOXALDH1A1TSHRKDM5AKDM4C
SCHEMBL28194422 0.86 TSHR (0.62) PAOXALDH1A1TSHRTDP1CHRM2
SCHEMBL6142226 0.86 TSHR (0.48) PAOXALDH1A1TSHRKDM5AKDM4C
SCHEMBL27373950 0.86 PAOX (0.48) PAOXALDH1A1TSHRKDM5AKDM4C
SCHEMBL3784120 0.86 TSHR (0.62) PAOXALDH1A1TSHRCHRM2MEN1

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
US-6284432-B1 COAT PROPERTY, HAS NOT SPECIAL COLOR UNEVENNESS AND CONTRAST SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2001-09-04 US disclosed
EP-0606632-A1 Pigment compounds and application thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1994-07-20 EP disclosed