SCHEMBL9751017

SCHEMBL9751017

CCCCCCCCCCCC(=O)Oc1ccc(/N=N/c2ccc(C(=O)C(F)(F)F)cc2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MLYCD O95822 4/20 0.48
KMT2A Q03164 4/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46
MEN1 O00255 1/20 0.44
SLC22A2 O15244 1/20 0.44
TMPRSS2 O15393 1/20 0.44
F2 P00734 1/20 0.44
F10 P00742 1/20 0.44
PLG P00747 1/20 0.44
F12 P00748 1/20 0.44
PLAU P00749 1/20 0.44
PLAT P00750 1/20 0.44
KLKB1 P03952 1/20 0.44
CYP1A2 P05177 1/20 0.44
HPN P05981 1/20 0.44
CHRM2 P08172 1/20 0.44
CYP2D6 P10635 1/20 0.44
SLC6A2 P23975 1/20 0.44

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
SCHEMBL9332185 1.00 MLYCD (0.48) MLYCDKMT2ASMN1; SMN2NPC1RAB9A
SCHEMBL9751008 0.84 TP53 (0.57) MLYCDNPC1RAB9A
SCHEMBL9331852 0.84 TP53 (0.57) MLYCDNPC1RAB9A
SCHEMBL28413264 0.84 STS (0.53) KMT2ASMN1; SMN2NPC1RAB9AMEN1
SCHEMBL8414417 0.84 KMT2A (0.50) KMT2ASMN1; SMN2NPC1RAB9AMEN1
SCHEMBL8414414 0.84 KMT2A (0.50) KMT2ASMN1; SMN2NPC1RAB9AMEN1
SCHEMBL28414791 0.84 STS (0.53) KMT2ASMN1; SMN2NPC1RAB9AMEN1
SCHEMBL11698316 0.82 KMT2A (0.53) KMT2ASMN1; SMN2NPC1RAB9AMEN1
SCHEMBL11698463 0.82 KMT2A (0.53) KMT2ASMN1; SMN2NPC1RAB9AMEN1
SCHEMBL11697221 0.82 KMT2A (0.53) KMT2ASMN1; SMN2NPC1RAB9AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5037968-A Ion Selective Membranes Of Ion Selective Electrodes; Color Indicators Moller, Willi (CH) 1991-08-06 US disclosed