SCHEMBL10340607

SCHEMBL10340607

NC(=O)c1c(C(=O)O)cnn1-c1cccc(Br)c1Cl

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RIPK2 O43353 1/20 0.39
MAPT P10636 3/20 0.35
POLB P06746 2/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
NR4A3 Q92570 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
SLC9A1 P19634 2/20 0.34
SLC9A2 Q9UBY0 1/20 0.34
KEAP1 Q14145 2/20 0.34
NFE2L2 Q16236 2/20 0.34
PRNP P04156 1/20 0.34
MAPK14 Q16539 2/20 0.34
ALKBH1 Q13686 1/20 0.34
TSHR P16473 1/20 0.33
GAA P10253 1/20 0.33
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
WNT3A P56704 1/20 0.33
SCN5A Q14524 1/20 0.33
SCN9A Q15858 1/20 0.33

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
SCHEMBL10340609 0.87 TSHR (0.45) RIPK2MAPTPOLBL3MBTL1NR4A3
SCHEMBL10340538 0.75 HTT (0.51) RIPK2MAPTPOLBL3MBTL1NR4A3
SCHEMBL10621062 0.74 MYC (0.38) RIPK2NR4A3SLC9A1SLC9A2MAPK14
SCHEMBL10340567 0.74 RIPK2 (0.47) RIPK2MAPTPOLBL3MBTL1NR4A3
SCHEMBL10340615 0.74 ALDH1A1 (0.48) SMN1; SMN2TSHRALDH1A1NOTUM
SCHEMBL10340610 0.73 RIPK2 (0.64) RIPK2MAPTPOLBL3MBTL1NR4A3
SCHEMBL10340641 0.72 PTPN1 (0.50) RIPK2MAPTPOLBL3MBTL1NR4A3
SCHEMBL10340690 0.72 RIPK2 (0.48) RIPK2MAPTPOLBL3MBTL1NR4A3
SCHEMBL10393453 0.71 RIPK2 (0.42) RIPK2MAPTPOLBL3MBTL1NR4A3
SCHEMBL14692428 0.70 FGFR1 (0.51) RIPK2MAPK14TSHRSCN5ASCN9A

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