SCHEMBL28059243

SCHEMBL28059243

CC(O)n1ccc2cc(C(=O)O)ccc21

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
RAPGEF4 Q8WZA2 1/20 0.47
HCAR3 P49019 5/20 0.47
HPGD P15428 1/20 0.43
HCAR2 Q8TDS4 1/20 0.43
RXRA P19793 1/20 0.43
KDM4E B2RXH2 3/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
PLA2G4A P47712 1/20 0.39
GRIN2D O15399 1/20 0.39
GRIN2A Q12879 1/20 0.39
GRIN2B Q13224 1/20 0.39
GRIN2C Q14957 1/20 0.39
HSD17B10 Q99714 1/20 0.38
RARA P10276 3/20 0.38
RARB P10826 3/20 0.38
RARG P13631 3/20 0.38

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
SCHEMBL4740640 0.89 HCAR3 (0.55) RAPGEF4HCAR3HPGDHCAR2RXRA
SCHEMBL16595470 0.76 HCAR3 (0.42) RAPGEF4HCAR3HPGDHCAR2RXRA
SCHEMBL30233739 0.76 TUBB4A (0.56) RAPGEF4HCAR3RXRAKDM4E
SCHEMBL103922 0.76 TUBB4A (0.56) RAPGEF4HCAR3RXRAKDM4E
SCHEMBL26119911 0.75 MAPK11 (0.53) RAPGEF4HCAR3HPGDHCAR2KDM4E
SCHEMBL17275595 0.75 RAPGEF4 (0.45) RAPGEF4HCAR3HPGDHCAR2RXRA
SCHEMBL5066699 0.75 KDM4E (0.51) RAPGEF4KDM4EPLA2G4AGRIN2DGRIN2A
SCHEMBL31335989 0.74 RAPGEF4 (0.49) RAPGEF4HCAR3HPGDHCAR2RXRA
Hydrazine SCHEMBL1997343 0.73 TUBB4A (0.54) RAPGEF4HCAR3RXRAKDM4E
SCHEMBL5066779 0.73 NOTUM (0.56) RAPGEF4HCAR3HPGDRXRAKDM4E

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
CN-102656141-B Micromolecular compound of simulation hemopoieticgrowth factor and uses thereof LIGAND PHARMACEUTICALS INC. (US) 2016-04-06 CN disclosed