SCHEMBL6863947

SCHEMBL6863947

O=C(O)CCCCCC(=O)Oc1ccc(C(=O)O)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.53
PRSS1 P07477 1/20 0.48
PRSS2 P07478 1/20 0.48
PRSS3 P35030 1/20 0.48
PPARA Q07869 1/20 0.47
HTT P42858 3/20 0.46
TP53 P04637 1/20 0.46
TSHR P16473 1/20 0.46
PDE4B Q07343 1/20 0.46
HSD17B10 Q99714 2/20 0.46
MEN1 O00255 1/20 0.46
SLC22A2 O15244 1/20 0.46
TMPRSS2 O15393 1/20 0.46
F2 P00734 1/20 0.46
F10 P00742 1/20 0.46
PLG P00747 1/20 0.46
F12 P00748 1/20 0.46
PLAU P00749 1/20 0.46
PLAT P00750 1/20 0.46
KLKB1 P03952 1/20 0.46

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
SCHEMBL28410126 1.00 KMT2A (0.53) KMT2APRSS1PRSS2PRSS3PPARA
SCHEMBL5792981 0.98 KMT2A (0.54) KMT2APRSS1PRSS2PRSS3PPARA
SCHEMBL6866162 0.95 PDE4B (0.51) KMT2APPARAHTTTP53TSHR
SCHEMBL6863945 0.95 KMT2A (0.58) KMT2APRSS1PRSS2PRSS3HTT
SCHEMBL5792985 0.93 KMT2A (0.59) KMT2APRSS1PRSS2PRSS3HTT
SCHEMBL12411508 0.90 KMT2A (0.53) KMT2APRSS1PRSS2PRSS3HTT
SCHEMBL6866158 0.89 KMT2A (0.55) KMT2AHTTTP53TSHRHSD17B10
SCHEMBL5075613 0.89 KMT2A (0.63) KMT2APRSS1PRSS2PRSS3PPARA
SCHEMBL12902938 0.88 KMT2A (0.51) KMT2APRSS1PRSS2PRSS3HTT
SCHEMBL622925 0.87 TP53 (0.64) KMT2AHTTTP53TSHRMEN1

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