SCHEMBL9430229

SCHEMBL9430229

O=C(Cc1ccc(F)cc1)c1cc(C(F)(F)F)ns1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.41
HTT P42858 3/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
KDM4E B2RXH2 3/20 0.40
MAPT P10636 2/20 0.40
HSD17B10 Q99714 2/20 0.40
TP53 P04637 2/20 0.40
ALOX15 P16050 1/20 0.40
MAPK1 P28482 1/20 0.40
RXRA P19793 3/20 0.39
RXRB P28702 3/20 0.39
RXRG P48443 3/20 0.39
XBP1 P17861 1/20 0.37
HIF1A Q16665 1/20 0.37
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
GAA P10253 1/20 0.36
EGFR P00533 1/20 0.36
ERBB2 P04626 1/20 0.36
CTBP2 P56545 1/20 0.36

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
SCHEMBL9135341 0.74 PLOD2 (0.43) HTTSMN1; SMN2NPC1RAB9A
SCHEMBL24958740 0.71 DAO (0.41) KDM4ERXRARXRBRXRGNPC1
SCHEMBL25183576 0.70 CDK8 (0.37) HTTKDM4ERAB9AGAAKMT2A
SCHEMBL5231872 0.70 P2RX7 (0.54) LMNAHTTSMN1; SMN2KDM4EMAPT
SCHEMBL17581950 0.68 CES2 (0.56) LMNAMAPTMEN1KMT2APOLB
SCHEMBL11267020 0.66 NPC1 (0.57) LMNAHTTSMN1; SMN2MAPTHSD17B10
SCHEMBL6339735 0.66 PTPN1 (0.56) NPC1RAB9AVNN1PIK3CA
SCHEMBL24958739 0.66 PKM (0.43) LMNAHTTKDM4EMAPTMAPK1
SCHEMBL6643910 0.66 DAO (0.47) LMNAHTTSMN1; SMN2KDM4EMAPT
SCHEMBL6201900 0.65 RAB9A (0.59) LMNAHTTSMN1; SMN2KDM4EMAPT

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-5338856-A 3,4-N,trisubstituted-4,5-dihydro-1H-pyrazole-1-carboxamides and their use as insecticides DOWELANCO (US) 1994-08-16 US disclosed