SCHEMBL7524544

SCHEMBL7524544

CON=C(C(C)=NOCc1ccccc1C(=NOC)C(N)=O)c1ccc(F)cc1F

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 8/20 0.40
PARP10 Q53GL7 2/20 0.39
PARP14 Q460N5 1/20 0.39
LMNA P02545 2/20 0.35
HTT P42858 1/20 0.35
PARP15 Q460N3 1/20 0.35
MAOB P27338 1/20 0.34
MAPK14 Q16539 1/20 0.34
NPC1 O15118 2/20 0.33
RAB9A P51151 2/20 0.33
POLB P06746 1/20 0.33
KMT2A Q03164 1/20 0.33
PKM P14618 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL6703054 0.90 HIF1A (0.52) HIF1APARP10PARP14PKM
SCHEMBL6703057 0.90 HIF1A (0.52) HIF1APARP10PARP14PKM
SCHEMBL8447501 0.83 HIF1A (0.46) HIF1ALMNAHTTNPC1SMN1; SMN2
SCHEMBL8447507 0.83 HIF1A (0.46) HIF1ALMNAHTTNPC1SMN1; SMN2
SCHEMBL7498106 0.83 HIF1A (0.51) HIF1ALMNANPC1RAB9APOLB
SCHEMBL7542482 0.81 HIF1A (0.40) HIF1ALMNANPC1RAB9APOLB
SCHEMBL7492770 0.81 HIF1A (0.51) HIF1APARP10PARP14LMNANPC1
SCHEMBL7504404 0.80 HIF1A (0.53) HIF1APARP10PARP14LMNAHTT
SCHEMBL7500240 0.79 HIF1A (0.40) HIF1APARP10PARP14LMNANPC1
SCHEMBL7498636 0.79 HIF1A (0.42) HIF1APARP10PARP14LMNAHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0837856-B1 PESTICIDAL TRIS-OXIMINO HETEROCYCLIC COMPOUNDS BAYER AG (DE) 2002-06-19 EP disclosed
EP-1184368-A1 Intermediates for pesticidal tris-oximino heterocyclic compounds BAYER AG (DE) 2002-03-06 EP disclosed
US-6150386-A PEST CONTROL, IN PARTICULAR, AS MICROBICIDES, INSECTICIDES AND ACARICIDES IN AGRICULTURE, IN HORTICULTURE AND HYGIENE SECTOR; CROP STORAGE; FUNGICIDES NOVARTIS CROP PROTECTION, INC. (US) 2000-11-21 US disclosed