SCHEMBL5168941

SCHEMBL5168941

Cc1cccc(SCCCCSc2cccc(C)c2)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 3/20 0.46
ALDH1A1 P00352 5/20 0.41
MAPK1 P28482 3/20 0.41
LMNA P02545 2/20 0.38
MAPT P10636 2/20 0.38
HTT P42858 2/20 0.38
KMT2A Q03164 2/20 0.38
MAOA P21397 1/20 0.38
MAOB P27338 1/20 0.38
MEN1 O00255 1/20 0.38
POLB P06746 1/20 0.38
DRD2 P14416 1/20 0.38
DRD4 P21917 1/20 0.38
DRD3 P35462 1/20 0.38
DHFR P00374 1/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2D6 P10635 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
SCHEMBL30753697 0.91 ALDH1A1 (0.50) ACHEALDH1A1MAPK1MAPTHTT
SCHEMBL7590844 0.91 ACHE (0.38) ACHEALDH1A1MAPK1LMNAMAPT
SCHEMBL425169 0.90 MAOA (0.45) ACHEALDH1A1MAPK1LMNAMAPT
SCHEMBL17277459 0.88 TAAR1 (0.44) ACHEALDH1A1MAPK1LMNAMAPT
SCHEMBL12460455 0.86 IGF1R (0.44) LMNAMAPTHTTKMT2AMEN1
SCHEMBL10144174 0.85 ACHE (0.44) ACHEALDH1A1MAPK1KMT2AMAOA
SCHEMBL17277336 0.85 KIF11 (0.49) ACHEALDH1A1MAPK1MAPTMAOA
SCHEMBL12460462 0.85 IGF1R (0.42) KMT2AMEN1POLBDRD2DRD4
SCHEMBL21102039 0.85 HDAC1 (0.38) ACHEALDH1A1MAPK1MAPTHTT
SCHEMBL21102257 0.83 ALDH1A1 (0.58) ALDH1A1MAPK1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1195259-B1 Sheet for ink jet-recording OJI PAPER CO (JP) 2007-04-25 EP disclosed
US-6852378-B2 Sheet for ink jet-recording OJI PAPER CO., LTD. (JP) 2005-02-08 US disclosed
US-20040058099-A1 Sheet for ink jet-recording OJI PAPER CO., LTD. 2004-03-25 US disclosed
EP-1195259-A2 Sheet for ink jet-recording OJI PAPER CO., LTD. (JP) 2002-04-10 EP disclosed