SCHEMBL9306207

SCHEMBL9306207

[CH2]Cc1ccc(C(=O)OC)cc1F

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 2/20 0.49
CA1 P00915 3/20 0.47
CA2 P00918 3/20 0.47
CA12 O43570 2/20 0.47
CA7 P43166 2/20 0.47
CA9 Q16790 2/20 0.47
CA14 Q9ULX7 2/20 0.47
XDH P47989 2/20 0.47
CYP1A2 P05177 1/20 0.46
CYP3A4 P08684 1/20 0.46
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 1/20 0.46
MAPT P10636 5/20 0.44
KDM4E B2RXH2 4/20 0.44
ALDH1A1 P00352 2/20 0.44
HPGD P15428 2/20 0.44
HSD17B10 Q99714 2/20 0.44
GAA P10253 2/20 0.44
GLA P06280 1/20 0.44
CASP1 P29466 1/20 0.44

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
SCHEMBL4123831 0.86 DPP4 (0.51) DPP4CA1CA2CA12CA7
SCHEMBL27150109 0.85 DPP4 (0.50) DPP4CA1CA2CA12CA7
SCHEMBL197186 0.83 DPP4 (0.49) DPP4CA1CA2CA12CA7
SCHEMBL1495847 0.83 LOXL2 (0.54) DPP4CA1CA2CA12CA7
SCHEMBL27547498 0.83 GABRA1 (0.41) DPP4CA1CA2CA12CA9
SCHEMBL8733705 0.82 DPP4 (0.48) DPP4CA1CA2CA12CA7
SCHEMBL14156934 0.82 DPP4 (0.48) DPP4CA1CA2CA12CA7
Hydrochloric Acid SCHEMBL12499887 0.82 LOXL2 (0.53) DPP4CA1CA2CA12CA7
SCHEMBL3653076 0.82 DPP4 (0.51) DPP4CA1CA2CA12CA7
SCHEMBL27359234 0.82 NPC1 (0.56) DPP4CA1CA2CA12CA7

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
US-5354729-A Controlling weeds at low dosage; nonphytotoxic SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1994-10-11 US disclosed
EP-0579469-A2 N-acyldihydroquinoline derivatives as herbicides SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1994-01-19 EP disclosed