SCHEMBL6866162

SCHEMBL6866162

O=C(O)CCCC(=O)Oc1ccc(C(=O)O)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 1/20 0.51
KMT2A Q03164 4/20 0.50
HSD17B10 Q99714 2/20 0.47
HTT P42858 2/20 0.47
ALDH1A1 P00352 2/20 0.47
LMNA P02545 1/20 0.47
MAPT P10636 1/20 0.47
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
PPARA Q07869 1/20 0.45
PKM P14618 1/20 0.44
EGFR P00533 1/20 0.44
ERBB2 P04626 1/20 0.44
TSHR P16473 3/20 0.44
TP53 P04637 2/20 0.44
ELANE P08246 1/20 0.44
ESR1 P03372 1/20 0.43
RECQL P46063 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
HIF1A Q16665 1/20 0.43

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
SCHEMBL5792981 0.96 KMT2A (0.54) PDE4BKMT2AHSD17B10HTTALDH1A1
SCHEMBL6863947 0.95 KMT2A (0.53) PDE4BKMT2AHSD17B10HTTALDH1A1
SCHEMBL28410126 0.95 KMT2A (0.53) PDE4BKMT2AHSD17B10HTTALDH1A1
SCHEMBL6866158 0.94 KMT2A (0.55) KMT2AHSD17B10HTTALDH1A1LMNA
SCHEMBL5792985 0.91 KMT2A (0.59) KMT2AHSD17B10HTTALDH1A1LMNA
SCHEMBL6863945 0.89 KMT2A (0.58) KMT2AHSD17B10HTTALDH1A1LMNA
SCHEMBL5075613 0.87 KMT2A (0.63) PDE4BKMT2AHSD17B10HTTALDH1A1
SCHEMBL12411508 0.84 KMT2A (0.53) KMT2AHSD17B10HTTALDH1A1LMNA
SCHEMBL2257309 0.84 TP53 (0.58) KMT2AHTTTSHRTP53ELANE
SCHEMBL7569171 0.83 PRSS1 (0.57) KMT2AHSD17B10HTTALDH1A1LMNA

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-6808766-B1 ALIGNMENT AGENT COMPRISING POLYURETHANE OR POLYUREA, USED IN ALIGNMENT OF LIQUID CRYSTAL MOLECULES THAT FORM LIQUID CRYSTAL ALIGNMENT FILM BY IRRADIATING THIN ALIGNMENT FILM FORMED ON SUBSTRATE WITH POLARIZED LIGHT OR ELECTRON RAYS NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2004-10-26 US disclosed
EP-1111442-A1 TREATING AGENT FOR LIQUID CRYSTAL ALIGNMENT LAYER AND LIQUID CRYSTAL DEVICE USING THE SAME, AND METHOD FOR ALIGNMENT OF LIQUID CRYSTAL Nissan Chemical Industries, Ltd. (JP) 2001-06-27 EP disclosed