SCHEMBL4116573

SCHEMBL4116573

CCCCCCCCCCc1c(C)sc(-c2sc(-c3sc(-c4sc(C)c(C)c4CCCCCCCCCC)c(C)c3CCCCCCCCCC)c(C)c2CCCCCCCCCC)c1C

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.33
LMNA P02545 1/20 0.33
HPGD P15428 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
GPR35 Q9HC97 5/20 0.31
TYR P14679 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
CCR5 P51681 1/20 0.30
TYMP P19971 2/20 0.30

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
SCHEMBL16624197 0.85 ALDH1A1 (0.38) ALDH1A1LMNAGPR35TYRCCR5
SCHEMBL13863664 0.85 ALDH1A1 (0.38) ALDH1A1LMNAGPR35TYRCCR5
SCHEMBL16624185 0.85 ALDH1A1 (0.38) ALDH1A1LMNAGPR35TYRCCR5
SCHEMBL16363792 0.85 ALDH1A1 (0.38) ALDH1A1LMNAGPR35TYRCCR5
SCHEMBL27964076 0.85 ALDH1A1 (0.38) ALDH1A1LMNAGPR35TYRCCR5
SCHEMBL9994207 0.74 TSHR (0.42) ALDH1A1LMNAGPR35TYMP
SCHEMBL13337265 0.74 TSHR (0.42) ALDH1A1LMNAGPR35TYMP
SCHEMBL18325070 0.74 TSHR (0.42) ALDH1A1LMNAGPR35TYMP
SCHEMBL28371745 0.72 GPR35 (0.36) ALDH1A1LMNAGPR35TYRCCR5
SCHEMBL12264588 0.72 ALDH1A1 (0.35) ALDH1A1LMNAGPR35TYRNPSR1

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
US-20170033292-A1 METHOD OF SELECTIVE SEPARATION OF SEMICONDUCTING CARBON NANOTUBES, DISPERSION OF SEMICONDUCTING CARBON NANOTUBES, AND ELECTRONIC DEVICE INCLUDING CARBON NANOTUBES SEPARATED BY USING THE METHOD SAMSUNG ELECTRONICS CO., LTD. (KR) 2017-02-02 US disclosed
US-9502152-B2 Method of selective separation of semiconducting carbon nanotubes, dispersion of semiconducting carbon nanotubes, and electronic device including carbon nanotubes separated by using the method SAMSUNG ELECTRONICS CO., LTD. (KR) 2016-11-22 US disclosed
US-20120104328-A1 Method of Selective Separation Of Semiconducting Carbon Nanotubes, Dispersion Of Semiconducting Carbon Nanotubes, And Electronic Device Including Carbon Nanotubes Separated By Using The Method THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 2012-05-03 US disclosed