SCHEMBL9788296

SCHEMBL9788296

CCc1c(C(=O)O)c(=O)cnn1-c1ccccc1Cl

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR4A3 Q92570 1/20 0.46
PDE4B Q07343 2/20 0.43
ALDH1A1 P00352 1/20 0.39
POLB P06746 1/20 0.39
MAPK14 Q16539 3/20 0.39
GAA P10253 2/20 0.39
HSD11B1 P28845 1/20 0.39
PDE9A O76083 2/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
PKM P14618 1/20 0.38
HPGD P15428 1/20 0.38
FPR1 P21462 1/20 0.37
NOTUM Q6P988 1/20 0.36
PDE4A P27815 1/20 0.36
PDE4C Q08493 1/20 0.36
PDE4D Q08499 1/20 0.36
FGFR1 P11362 1/20 0.35
SRC P12931 1/20 0.35
FGFR2 P21802 1/20 0.35

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
SCHEMBL9005789 0.86 NR4A3 (0.47) NR4A3ALDH1A1POLBMAPK14HSD11B1
SCHEMBL9788273 0.82 NR4A3 (0.67) NR4A3ALDH1A1POLBMAPK14GAA
SCHEMBL9788353 0.80 CRHBP (0.38) NR4A3ALDH1A1
SCHEMBL122191 0.79 NR4A3 (0.51) NR4A3ALDH1A1GAAHSD11B1MEN1
SCHEMBL9005822 0.79 NR4A3 (0.51) NR4A3ALDH1A1GAAHSD11B1KMT2A
SCHEMBL10357768 0.79 PDE4B (0.44) NR4A3PDE4BALDH1A1MAPK14GAA
SCHEMBL4411084 0.78 NR4A3 (0.50) NR4A3ALDH1A1GAAHSD11B1MEN1
SCHEMBL9788312 0.76 RAB9A (0.40) ALDH1A1POLBGAAMEN1KMT2A
SCHEMBL9005834 0.75 NR4A3 (0.52) NR4A3ALDH1A1POLBGAAHSD11B1
SCHEMBL9458510 0.74 NR4A3 (0.51) NR4A3ALDH1A1POLBHSD11B1MEN1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5062880-A Male plant sterility MONSANTO COMPANY (US) 1991-11-05 US disclosed
US-4732603-A ANTIFERTILITY AGENTS ROHM AND HAAS COMPANY (US) 1988-03-22 US disclosed
EP-0049971-B1 SUBSTITUTED PYRIDAZINES, PROCESSES FOR MAKING THEM, THEIR USE AS PLANT GROWTH REGULATORS, AND PLANT GROWTH REGULATING COMPOSITIONS CONTAINING THEM ROHM AND HAAS COMPANY (US) 1987-04-08 EP disclosed
EP-0049971-A1 Substituted pyridazines, processes for making them, their use as plant growth regulators, and plant growth regulating compositions containing them ROHM AND HAAS COMPANY (US) 1982-04-21 EP disclosed