SCHEMBL7760446

SCHEMBL7760446

O=C(O)c1cc(C(=O)O)c(C(=O)O)c(-c2cccc(-c3cc(C(=O)O)cc(C(=O)O)c3C(=O)O)c2)c1

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
DDT P30046 1/20 0.49
KMO O15229 1/20 0.47
FOLH1 Q04609 2/20 0.44
DHODH Q02127 4/20 0.44
ACMSD Q8TDX5 1/20 0.42
CDC25B P30305 2/20 0.41
CDC25A P30304 1/20 0.41
HSD17B10 Q99714 1/20 0.41
ATM Q13315 1/20 0.41
HNF4A P41235 1/20 0.41
PLA2G2A P14555 1/20 0.40
KDM4E B2RXH2 1/20 0.40
EGFR P00533 1/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39

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
SCHEMBL671824 0.93 DDT (0.57) DDTKMOFOLH1PLA2G2AKDM4E
SCHEMBL9423207 0.91 PTPN1 (0.47) DDTKMOFOLH1DHODHACMSD
SCHEMBL30883369 0.89 PTPN1 (0.46) DDTKMOFOLH1DHODHACMSD
SCHEMBL31106599 0.89 CA12 (0.38) DDTKMOFOLH1DHODHCDC25B
SCHEMBL2791940 0.87 HSD17B10 (0.44) DDTFOLH1DHODHCDC25BCDC25A
SCHEMBL10321702 0.84 PTPN1 (0.43) DDTFOLH1DHODHACMSDCDC25B
SCHEMBL30223654 0.83 HNF4A (0.46) KMOFOLH1DHODHCDC25BCDC25A
SCHEMBL7139018 0.79 HNF4A (0.53) DDTKMOFOLH1ACMSDCDC25B
SCHEMBL27893408 0.79 DDT (0.57) DDTKMOFOLH1DHODHACMSD
SCHEMBL7202717 0.79 CDC25A (0.49) FOLH1CDC25BCDC25AHSD17B10KDM4E

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
EP-1103366-A1 OPEN TYPE POLYIMIDE MOLDED PRODUCT AND PRODUCTION METHOD THEREOF DU PONT-TORAY COMPANY, LTD. (JP) 2001-05-30 EP disclosed