SCHEMBL7127230

SCHEMBL7127230

CON=C(C(C)=C(ON)c1ccccc1C(=NOC)C(=O)OC)c1ccc(Cl)cc1

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 6/20 0.46
SMN1; SMN2 Q16637 2/20 0.40
NPC1 O15118 1/20 0.40
MAPT P10636 1/20 0.40
CYP1A2 P05177 2/20 0.38
CYP2D6 P10635 2/20 0.38
CYP2C9 P11712 2/20 0.38
CYP2C19 P33261 2/20 0.38
MEN1 O00255 1/20 0.38
ALDH1A1 P00352 1/20 0.38
KMT2A Q03164 1/20 0.38
F10 P00742 1/20 0.38
LMNA P02545 1/20 0.38
HPGD P15428 1/20 0.38
RAB9A P51151 1/20 0.38
SLC6A4 P31645 1/20 0.35
SLC6A3 Q01959 1/20 0.35
MIF P14174 1/20 0.34
POLB P06746 1/20 0.34

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
SCHEMBL8030793 0.83 HIF1A (0.35) HIF1ASMN1; SMN2NPC1MAPTCYP1A2
SCHEMBL7494934 0.81 PARP10 (0.39) HIF1ASMN1; SMN2NPC1MAPTALDH1A1
SCHEMBL7464106 0.80 HIF1A (0.35) HIF1ASMN1; SMN2NPC1MAPTCYP1A2
SCHEMBL8721309 0.79 HIF1A (0.43) HIF1A
SCHEMBL7498105 0.78 HIF1A (0.39) HIF1ASMN1; SMN2NPC1MAPTMEN1
SCHEMBL7498151 0.78 HIF1A (0.46) HIF1AMAPT
SCHEMBL6703061 0.77 HIF1A (0.39) HIF1AMAPT
SCHEMBL6781009 0.77 HIF1A (0.46) HIF1ASMN1; SMN2NPC1MAPTCYP1A2
SCHEMBL6155140 0.77 HIF1A (0.40) HIF1ASMN1; SMN2NPC1MAPTALDH1A1
SCHEMBL6155148 0.77 HIF1A (0.40) HIF1ASMN1; SMN2NPC1MAPTALDH1A1

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
US-6664422-B1 Process for the preparation of strobilurin intermediates BAYER AKTIENGESELLSCHAFT (DE) 2003-12-16 US disclosed
EP-1137627-A1 PROCESS FOR THE PREPARATION OF STROBILURIN INTERMEDIATES Bayer Aktiengesellschaft (DE) 2001-10-04 EP disclosed
WO-2000034229-A1 PROCESS FOR THE PREPARATION OF STROBILURIN INTERMEDIATES BAYER AKTIENGESELLSCHAFT (DE) 2000-06-15 WO disclosed