SCHEMBL10340690

SCHEMBL10340690

NC(=O)c1c(C(=O)O)cnn1-c1ccc(Br)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RIPK2 O43353 1/20 0.48
SMN1; SMN2 Q16637 3/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
NR4A3 Q92570 1/20 0.42
POLB P06746 1/20 0.42
MAPT P10636 1/20 0.42
KEAP1 Q14145 1/20 0.41
NFE2L2 Q16236 1/20 0.41
RAB9A P51151 4/20 0.40
NPC1 O15118 3/20 0.40
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
LMNA P02545 2/20 0.39
MAPK14 Q16539 2/20 0.39
GLA P06280 1/20 0.39
NFKB1 P19838 1/20 0.39
NFKB2 Q00653 1/20 0.39
RELA Q04206 1/20 0.39
SLC9A1 P19634 1/20 0.39
SLC9A2 Q9UBY0 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
SCHEMBL10340610 0.86 RIPK2 (0.64) RIPK2SMN1; SMN2L3MBTL1NR4A3POLB
SCHEMBL10393416 0.85 RIPK2 (0.41) RIPK2SMN1; SMN2L3MBTL1NR4A3POLB
SCHEMBL10340579 0.85 RAB9A (0.50) RIPK2SMN1; SMN2L3MBTL1NR4A3POLB
SCHEMBL10340641 0.85 PTPN1 (0.50) RIPK2SMN1; SMN2L3MBTL1NR4A3POLB
SCHEMBL10624292 0.85 MAPK14 (0.53) RIPK2SMN1; SMN2L3MBTL1NR4A3POLB
SCHEMBL10340567 0.83 RIPK2 (0.47) RIPK2SMN1; SMN2L3MBTL1NR4A3POLB
SCHEMBL594205 0.81 RIPK2 (0.58) RIPK2SMN1; SMN2POLBRAB9ANPC1
SCHEMBL10621474 0.81 ALKBH5 (0.42) RIPK2SMN1; SMN2L3MBTL1NR4A3MAPT
SCHEMBL10394150 0.79 MAPK1 (0.37) RIPK2SMN1; SMN2L3MBTL1NR4A3POLB
SCHEMBL10340571 0.78 PTPN1 (0.48) RIPK2SMN1; SMN2L3MBTL1NR4A3POLB

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
EP-0177242-B1 POLLEN FORMATION INHIBITING PYRAZOLES ELI LILLY AND COMPANY (US) 1990-01-03 EP disclosed
US-4775409-A PREVENTING POLLEN FORMATION ELI LILLY AND COMPANY (US) 1988-10-04 US disclosed
US-4666504-A HYBRIDS ELI LILLY AND COMPANY (US) 1987-05-19 US disclosed
EP-0177242-A2 Pollen formation inhibiting pyrazoles ELI LILLY AND COMPANY (US) 1986-04-09 EP disclosed