SCHEMBL6759295

SCHEMBL6759295

O=C(O)c1cccc(C(F)c2ccccc2C(=O)O)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ANPEP P15144 1/20 0.46
ENPEP Q07075 1/20 0.46
ALDH1A1 P00352 4/20 0.44
KMT2A Q03164 2/20 0.44
GAA P10253 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
KDM4E B2RXH2 2/20 0.42
KMO O15229 1/20 0.42
PTPN1 P18031 1/20 0.41
AKR1C3 P42330 2/20 0.41
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA6 P23280 1/20 0.41
CA9 Q16790 1/20 0.41
MAPT P10636 2/20 0.40
PTGS1 P23219 2/20 0.40
CXCR1 P25024 2/20 0.40
CXCR2 P25025 2/20 0.40
PTGS2 P35354 2/20 0.40

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
SCHEMBL6756207 0.83 ANPEP (0.58) ANPEPENPEPALDH1A1KDM4EKMO
SCHEMBL6756199 0.79 ALDH1A1 (0.56) ALDH1A1KMT2AGAATDP1KDM4E
SCHEMBL6756363 0.77 ANPEP (0.51) ANPEPENPEPKMT2AKMOCA12
SCHEMBL315064 0.76 ANPEP (0.58) ANPEPENPEPALDH1A1KDM4EKMO
Isophthalic Acid SCHEMBL1250697 0.73 ALDH1A1 (0.67) ALDH1A1KMT2ATDP1KDM4EKMO
SCHEMBL27595258 0.73 ANPEP (0.54) ANPEPENPEPALDH1A1KDM4EKMO
SCHEMBL19529333 0.73 ANPEP (0.54) ANPEPENPEPALDH1A1KDM4EKMO
SCHEMBL10653107 0.73 ANPEP (0.54) ANPEPENPEPALDH1A1KDM4EKMO
SCHEMBL10483662 0.73 ANPEP (0.44) ANPEPENPEPALDH1A1KDM4EPTPN1
SCHEMBL8459853 0.72 ANPEP (0.54) ANPEPENPEPALDH1A1KMOCA12

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-20040152862-A1 Optical resins and applications thereof HITACHI CHEMICAL CO., LTD. (JP) 2004-08-05 US disclosed