SCHEMBL10447248

SCHEMBL10447248

O=CCc1ncc(C(=O)O)cc1C(=O)O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MGAM O43451 1/20 0.38
▸ P4HA1 P13674 3/20 0.36
▸ P4HTM Q9NXG6 2/20 0.36
▸ MIF P14174 1/20 0.35
▸ HCAR2 Q8TDS4 4/20 0.34
▸ KDM4E B2RXH2 4/20 0.34
▸ ALDH1A1 P00352 4/20 0.34
▸ MAPT P10636 3/20 0.34
▸ GABRP O00591 3/20 0.34
▸ GABRD O14764 3/20 0.34
▸ GABRA1 P14867 3/20 0.34
▸ GABRB1 P18505 3/20 0.34
▸ GABRG2 P18507 3/20 0.34
▸ GABRB3 P28472 3/20 0.34
▸ GABRA5 P31644 3/20 0.34
▸ GABRA3 P34903 3/20 0.34
▸ GABRA2 P47869 3/20 0.34
▸ GABRB2 P47870 3/20 0.34
▸ GABRA4 P48169 3/20 0.34
▸ GABRE P78334 3/20 0.34

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
SCHEMBL10764581 0.80 HCAR2 (0.41) MGAMP4HA1P4HTMMIFHCAR2
SCHEMBL9037560 0.79 HCAR2 (0.40) MGAMP4HA1P4HTMMIFHCAR2
SCHEMBL19857480 0.79 GABRP (0.46) MGAMP4HA1P4HTMHCAR2KDM4E
SCHEMBL29819483 0.76 TSHR (0.44) MGAMP4HA1P4HTMMIFKDM4E
SCHEMBL10768874 0.74 MGAM (0.37) MGAMP4HA1P4HTMKDM4EALDH1A1
SCHEMBL10768873 0.72 MGAM (0.35) MGAMP4HA1P4HTMMIFHCAR2
SCHEMBL10768907 0.72 MGAM (0.38) MGAMP4HA1P4HTMMIFKDM4E
SCHEMBL10766358 0.71 HTT (0.53) MGAMMAPTKDM4CMEN1KMT2A
SCHEMBL10770003 0.71 TBXAS1 (0.50) MEN1KMT2ALMNA
SCHEMBL10515854 0.70 ASPH (0.50) MGAMKDM4EKDM6BKDM4AKDM4D

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-0362908-A2 1,4-Dihydropyridine dicarboxylic acid derivatives ZAMBON GROUP S.p.A. (IT) 1990-04-11 — — EP disclosed
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