SCHEMBL9019947

SCHEMBL9019947

CON=C(C(=O)OC)c1cccc(OCc2ccccc2F)c1

nearest known ligand 0.67

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 8/20 0.67
HPD P32754 1/20 0.53
MAOB P27338 3/20 0.49
SPHK2 Q9NRA0 1/20 0.48
PARP15 Q460N3 2/20 0.47
PARP10 Q53GL7 2/20 0.47
PARP14 Q460N5 1/20 0.46
LMNA P02545 1/20 0.45
NPC1 O15118 1/20 0.44
NR4A2 P43354 1/20 0.44
RAB9A P51151 1/20 0.44
PTPN2 P17706 1/20 0.43
PTPN1 P18031 1/20 0.43
CDC25B P30305 1/20 0.43
RARA P10276 1/20 0.43
RARB P10826 1/20 0.43
RARG P13631 1/20 0.43
GCK P35557 1/20 0.43
MRGPRX4 Q96LA9 1/20 0.42

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
SCHEMBL9019934 0.83 HIF1A (0.71) HIF1AMAOBNR4A2PTPN1MRGPRX4
SCHEMBL9449532 0.81 HIF1A (0.86) HIF1AMAOB
SCHEMBL28895738 0.80 HIF1A (1.00) HIF1AMAOBNPC1NR4A2RAB9A
SCHEMBL28966855 0.80 HIF1A (1.00) HIF1AMAOBNPC1NR4A2RAB9A
SCHEMBL28895739 0.80 HIF1A (1.00) HIF1AMAOBNPC1NR4A2RAB9A
SCHEMBL2087291 0.79 MAOB (0.72) HPDMAOBSPHK2PARP15PARP10
SCHEMBL9660188 0.77 CES2 (0.57) HIF1ANPC1RAB9A
SCHEMBL9660191 0.77 CES2 (0.57) HIF1ANPC1RAB9A
SCHEMBL22414343 0.77 HIF1A (1.00) HIF1ASPHK2PARP15PARP10NPC1
SCHEMBL4638452 0.76 PARP10 (0.72) HPDMAOBSPHK2PARP15PARP10

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-0422597-B1 Derivatives of phenylacetic acid and fungicides containing them BASF AG (DE) 1996-07-24 EP disclosed
US-5286750-A For crops or ornamental plants BASF AKTIENGESELLSCHAFT (DE) 1994-02-15 US disclosed
EP-0422597-A2 Derivatives of phenylacetic acid and fungicides containing them BASF Aktiengesellschaft (DE) 1991-04-17 EP disclosed