SCHEMBL3912901

SCHEMBL3912901

CCCOC1CCC2CC(C(=O)O)CCC2C1

nearest known ligand 0.33

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.33
NPC1 O15118 1/20 0.33
ALDH1A1 P00352 1/20 0.33
RAB9A P51151 1/20 0.33
PPM1B O75688 1/20 0.33
PTPN1 P18031 1/20 0.33
PPP1CC P36873 1/20 0.33
TAAR1 Q96RJ0 1/20 0.32
ACE P12821 1/20 0.31
EPHX2 P34913 1/20 0.31
PLG P00747 1/20 0.31
PLAT P00750 1/20 0.31
LMNA P02545 1/20 0.31
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
AKR1C3 P42330 1/20 0.30
AKR1C1 Q04828 1/20 0.30
PPP5C P53041 1/20 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
SCHEMBL8969589 0.90 PPM1B (0.36) PPM1BPTPN1PPP1CCTAAR1ACE
SCHEMBL11159892 0.83 PLG (0.41) ALDH1A1PPM1BPTPN1PPP1CCTAAR1
SCHEMBL601771 0.83 PLG (0.41) ALDH1A1PPM1BPTPN1PPP1CCTAAR1
SCHEMBL2280422 0.83 PLG (0.41) ALDH1A1PPM1BPTPN1PPP1CCTAAR1
SCHEMBL8970567 0.80 PPP5C (0.43) NPC1ALDH1A1RAB9AEPHX2PPP5C
SCHEMBL4748850 0.80 BTK (0.40) SMN1; SMN2PPM1BPTPN1PPP1CCTAAR1
SCHEMBL4748848 0.80 BTK (0.40) SMN1; SMN2PPM1BPTPN1PPP1CCTAAR1
SCHEMBL4748851 0.80 BTK (0.40) SMN1; SMN2PPM1BPTPN1PPP1CCTAAR1
SCHEMBL8969446 0.79 EPHX2 (0.45) EPHX2PPP5C
SCHEMBL10358341 0.78 ACE (0.35) ACEEPHX2PLGPLATLMNA

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-2022830-A1 MAGENTA INK COMPOSITION, INK SET, INK CARTRIDGE, INKJET RECORDING METHOD AND RECORDED MATTER Seiko Epson Corporation (JP) 2009-02-11 EP disclosed
US-7416592-B2 Magenta ink composition, ink set, ink cartridge, inkjet recording method and recorded product SEIKO EPSON CORPORATION (JP) 2008-08-26 US disclosed
US-20070263055-A1 MAGENTA INK COMPOSITION, INK SET, INK CARTRIDGE, INKJET RECORDING METHOD AND RECORDED PRODUCT SEIKO EPSON CORPORATION 2007-11-15 US disclosed