SCHEMBL9788258

SCHEMBL9788258

CCc1c(C(=O)O)c(=O)cnn1-c1ccc(Br)cc1C(F)(F)F

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HCAR1 Q9BXC0 1/20 0.37
NR4A3 Q92570 1/20 0.35
EPRS1 P07814 1/20 0.32
RBP4 P02753 1/20 0.32
MEN1 O00255 3/20 0.32
KMT2A Q03164 3/20 0.32
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
PTGER1 P34995 4/20 0.32
MYC P01106 1/20 0.32
NR4A1 P22736 1/20 0.32
MAPT P10636 3/20 0.31
SMN1; SMN2 Q16637 2/20 0.31
PRNP P04156 1/20 0.31
TP53 P04637 1/20 0.31
RXFP1 Q9HBX9 1/20 0.31
POLB P06746 1/20 0.30
AR P10275 2/20 0.30
RORC P51449 1/20 0.30
XPO1 O14980 1/20 0.30

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
SCHEMBL10715183 0.82 HCAR1 (0.36) HCAR1EPRS1RBP4MEN1KMT2A
SCHEMBL9458510 0.78 NR4A3 (0.51) NR4A3MEN1KMT2ANPC1RAB9A
SCHEMBL9788353 0.76 CRHBP (0.38) NR4A3NPC1RAB9AMAPT
SCHEMBL9788349 0.72 LMNA (0.47) HCAR1RAB9AMYCNR4A1MAPT
SCHEMBL9005789 0.72 NR4A3 (0.47) NR4A3MEN1KMT2AMAPTSMN1; SMN2
SCHEMBL9788296 0.71 NR4A3 (0.46) NR4A3MEN1KMT2APOLB
SCHEMBL9788273 0.71 NR4A3 (0.67) NR4A3MEN1KMT2ANPC1RAB9A
SCHEMBL9005834 0.69 NR4A3 (0.52) NR4A3MEN1KMT2ANPC1RAB9A
SCHEMBL122191 0.68 NR4A3 (0.51) NR4A3MEN1KMT2ANPC1RAB9A
SCHEMBL9005822 0.68 NR4A3 (0.51) NR4A3KMT2ANPC1RAB9AMAPT

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