SCHEMBL7528148

SCHEMBL7528148

O=C(Cl)Nc1ccc(OC(F)F)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.59
KMT2A Q03164 4/20 0.54
LMNA P02545 2/20 0.54
ALOX15 P16050 1/20 0.51
GFER P55789 1/20 0.51
ADAM17 P78536 1/20 0.51
MAPT P10636 5/20 0.51
MEN1 O00255 3/20 0.51
POLB P06746 2/20 0.51
NPSR1 Q6W5P4 2/20 0.51
SMN1; SMN2 Q16637 2/20 0.51
HTT P42858 1/20 0.51
GLA P06280 1/20 0.50
MAPK1 P28482 1/20 0.50
KDM4E B2RXH2 2/20 0.49
TEAD4 Q15561 1/20 0.49
HPGD P15428 1/20 0.48
HSD17B10 Q99714 1/20 0.48
STING1 Q86WV6 1/20 0.48
APOBEC3A P31941 1/20 0.48

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
SCHEMBL4118526 0.85 MAPT (0.66) ALDH1A1KMT2ALMNAALOX15GFER
SCHEMBL3714311 0.83 ALDH1A1 (0.66) ALDH1A1KMT2ALMNAALOX15GFER
SCHEMBL2476390 0.81 GLA (0.69) ALDH1A1KMT2ALMNAALOX15GFER
SCHEMBL5952262 0.81 MEN1 (0.61) ALDH1A1KMT2ALMNAALOX15GFER
SCHEMBL20679552 0.81 RNF4 (0.59) ALDH1A1KMT2AMAPTMEN1POLB
SCHEMBL4121665 0.81 KMT2A (0.58) ALDH1A1KMT2ALMNAMAPTMEN1
SCHEMBL4105408 0.81 GLA (0.63) ALDH1A1KMT2ALMNAMAPTMEN1
Urea SCHEMBL4110289 0.80 MAPT (0.61) ALDH1A1KMT2ALMNAALOX15GFER
SCHEMBL21695331 0.80 ALDH1A1 (0.58) ALDH1A1KMT2ALMNAALOX15GFER
SCHEMBL23624082 0.79 ALDH1A1 (0.56) ALDH1A1KMT2ALMNAALOX15GFER

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
EP-1183246-A1 TETRAZOLINONE DERIVATIVES NIHON BAYER AGROCHEM K.K. (JP) 2002-03-06 EP disclosed
WO-2000071527-A1 TETRAZOLINONE DERIVATIVES NIHON BAYER AGROCHEM K.K. (DE) 2000-11-30 WO disclosed