SCHEMBL9689012

SCHEMBL9689012

CCCCCCCCCCCCCCCCCCOC(CC)c1cc(C(=O)O)ccc1-c1ccc(CCCCCCC)cc1

nearest known ligand 0.64

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RARB P10826 15/20 0.64
RARA P10276 2/20 0.57
MEN1 O00255 1/20 0.57
ALDH1A1 P00352 1/20 0.57
MAPT P10636 1/20 0.57
MTOR P42345 1/20 0.57
KMT2A Q03164 1/20 0.57
PTPN11 Q06124 2/20 0.50
RARG P13631 1/20 0.46
NPC1 O15118 1/20 0.45
NFKB1 P19838 1/20 0.45
RAB9A P51151 1/20 0.45
NFKB2 Q00653 1/20 0.45
RELA Q04206 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45

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
SCHEMBL9689028 0.88 RARB (0.63) RARBPTPN11
SCHEMBL9688540 0.88 RARB (0.63) RARBPTPN11
SCHEMBL9688552 0.84 PTPN11 (0.68) RARBPTPN11
SCHEMBL4330679 0.78 RARB (1.00) RARBRARAMEN1ALDH1A1MAPT
SCHEMBL13779190 0.77 RARB (1.00) RARBRARAMEN1ALDH1A1MAPT
SCHEMBL4190781 0.77 RARB (1.00) RARBRARAMEN1ALDH1A1MAPT
SCHEMBL9798004 0.77 RARB (0.67) RARBRARAMEN1ALDH1A1MAPT
SCHEMBL9688485 0.77 RARB (0.44) RARBRARAMEN1ALDH1A1MAPT
SCHEMBL5065174 0.76 RARB (0.65) RARBRARAMEN1ALDH1A1MAPT
SCHEMBL10774091 0.76 RARB (0.65) RARBRARAMEN1ALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5167857-A Optically active, optical modulation CANON KABUSHIKI KAISHA (JP) 1992-12-01 US claimed
EP-0175591-B1 LACTIC ACID DERIVATIVE, LIQUID CRYSTAL COMPOSITION CONTAINING SAME AND LIQUID CRYSTAL DEVICE CANON KABUSHIKI KAISHA (JP) 1991-03-06 EP claimed
EP-0175591-A2 Lactic acid derivative, liquid crystal composition containing same and liquid crystal device CANON KABUSHIKI KAISHA (JP) 1986-03-26 EP claimed
US-5167857-A Optically active, optical modulation CANON KABUSHIKI KAISHA (JP) 1992-12-01 US disclosed
EP-0175591-B1 LACTIC ACID DERIVATIVE, LIQUID CRYSTAL COMPOSITION CONTAINING SAME AND LIQUID CRYSTAL DEVICE CANON KABUSHIKI KAISHA (JP) 1991-03-06 EP disclosed
US-4775223-A DISPLAY DEVICE CANON KABUSHIKI KAISHA (JP) 1988-10-04 US disclosed
EP-0175591-A2 Lactic acid derivative, liquid crystal composition containing same and liquid crystal device CANON KABUSHIKI KAISHA (JP) 1986-03-26 EP disclosed