SCHEMBL16273631

SCHEMBL16273631

Cc1cc(O)c(C)c(F)c1OCc1ccccc1[N+](=O)[O-]

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 1/20 0.47
ALDH1A1 P00352 5/20 0.43
MAPT P10636 2/20 0.43
MAPK1 P28482 1/20 0.43
KMT2A Q03164 4/20 0.43
MEN1 O00255 3/20 0.43
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
CA12 O43570 1/20 0.42
CA9 Q16790 1/20 0.42
HTR1A P08908 1/20 0.41
ADRA1D P25100 1/20 0.41
ADRA1A P35348 1/20 0.41
ADRA1B P35368 1/20 0.41
HTT P42858 1/20 0.40
TSHR P16473 1/20 0.38
CCR5 P51681 1/20 0.38
HSD17B10 Q99714 1/20 0.38
LMNA P02545 1/20 0.38

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
SCHEMBL17616611 0.89 MAOB (0.47) MAOBALDH1A1MAPTMAPK1KMT2A
SCHEMBL16273630 0.83 MAOB (0.49) MAOBALDH1A1MAPTMAPK1KMT2A
SCHEMBL16273614 0.80 MAOB (0.48) MAOBALDH1A1MAPTMAPK1KMT2A
SCHEMBL17616589 0.79 MAOB (0.47) MAOBALDH1A1MAPTMAPK1KMT2A
SCHEMBL16273704 0.79 FFAR1 (0.34) MAOBALDH1A1MAPTKMT2AMEN1
SCHEMBL16273626 0.79 MAOB (0.47) MAOBALDH1A1MAPTMAPK1KMT2A
SCHEMBL16273634 0.78 MRGPRX4 (0.46) ALDH1A1HTTTHRB
SCHEMBL16273625 0.78 MAOB (0.49) MAOBALDH1A1MAPTMAPK1KMT2A
SCHEMBL7268739 0.78 MAOB (0.51) MAOBALDH1A1MAPTMAPK1KMT2A
SCHEMBL16273706 0.78 MAOB (0.51) MAOBALDH1A1MAPTMAPK1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9675072-B2 Tetrazolinone compound and application of same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-06-13 US disclosed
EP-3029030-A1 TETRAZOLINONE COMPOUND, AND USE THEREFOR Sumitomo Chemical Company, Limited (JP) 2016-06-08 EP disclosed
EP-3006440-A1 TETRAZOLINONE COMPOUND AND APPLICATION OF SAME Sumitomo Chemical Company Limited (JP) 2016-04-13 EP disclosed
WO-2015016373-A1 TETRAZOLINONE COMPOUND, AND USE THEREFOR 住友化学株式会社 (JP) 2015-02-05 WO disclosed
WO-2014192953-A1 TETRAZOLINONE COMPOUND AND APPLICATION OF SAME 住友化学株式会社 (JP) 2014-12-04 WO disclosed