SCHEMBL11238802

SCHEMBL11238802

NC(=O)c1c(Cl)ccc(C(=O)O)c1C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 1/20 0.50
ALDH1A1 P00352 5/20 0.44
KDM4E B2RXH2 3/20 0.44
KMT2A Q03164 3/20 0.44
HSD17B10 Q99714 2/20 0.44
ATM Q13315 1/20 0.44
TSHR P16473 4/20 0.44
TP53 P04637 1/20 0.44
CASP1 P29466 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
POLB P06746 2/20 0.42
NPC1 O15118 1/20 0.42
MAPT P10636 1/20 0.42
RAB9A P51151 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
PBRM1 Q86U86 1/20 0.41
CYP1A2 P05177 1/20 0.39
CXCR2 P25025 1/20 0.37
LMNA P02545 1/20 0.37
MEN1 O00255 1/20 0.36

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
SCHEMBL11238797 0.92 DPP4 (0.50) DPP4ALDH1A1KDM4EKMT2AHSD17B10
SCHEMBL10771891 0.87 DPP4 (0.58) DPP4ALDH1A1KDM4EKMT2AHSD17B10
SCHEMBL9450686 0.87 DPP4 (0.58) DPP4ALDH1A1KDM4EKMT2AHSD17B10
SCHEMBL3650105 0.84 TSHR (0.48) DPP4ALDH1A1KDM4EKMT2AHSD17B10
SCHEMBL3043501 0.82 DPP4 (0.52) DPP4ALDH1A1KDM4EKMT2AHSD17B10
SCHEMBL9724650 0.81 CYP1A2 (0.44) ALDH1A1KDM4EKMT2AHSD17B10ATM
SCHEMBL27708034 0.81 CYP1A2 (0.48) ALDH1A1KDM4EKMT2AHSD17B10ATM
SCHEMBL9432668 0.81 CYP1A2 (0.48) ALDH1A1KDM4EKMT2AHSD17B10ATM
SCHEMBL9450703 0.80 TSHR (0.59) ALDH1A1KDM4EKMT2AHSD17B10TSHR
SCHEMBL2193428 0.78 DPP4 (0.52) DPP4ALDH1A1KDM4EKMT2AHSD17B10

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-4328339-A Continuous preparation of isatoic anhydride BASF AKTIENGESELLSCHAFT (DE) 1982-05-04 US disclosed
US-3984406-A FROM AN ALKALI METAL PHTHALAMATE AND A HYPOHALITE IN A HALOGEN CATALYST BASF AKTIENGESELLSCHAFT (DT) 1976-10-05 US disclosed