SCHEMBL11478539

SCHEMBL11478539

Cn1c(=O)[nH]c(=O)n(-c2ccc(Oc3ccc(SC(F)(F)F)cc3)c(C(F)(F)F)c2)c1=O

nearest known ligand 0.45

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
NTRK1 P04629 15/20 0.45
NTRK2 Q16620 15/20 0.45
NTRK3 Q16288 11/20 0.45
IGF1R P08069 5/20 0.43
FGFR1 P11362 5/20 0.43
BRAF P15056 4/20 0.35
BCAT2 O15382 1/20 0.33
BCAT1 P54687 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
Toltrazuril SCHEMBL29509205 0.88 NTRK1 (0.57) NTRK1NTRK2NTRK3IGF1RFGFR1
Toltrazuril SCHEMBL248912 0.88 NTRK1 (0.57) NTRK1NTRK2NTRK3IGF1RFGFR1
Toltrazuril SCHEMBL21812043 0.88 NTRK1 (0.57) NTRK1NTRK2NTRK3IGF1RFGFR1
SCHEMBL10525684 0.88 NTRK1 (0.58) NTRK1NTRK2NTRK3IGF1RFGFR1
SCHEMBL10525747 0.85 NTRK1 (0.51) NTRK1NTRK2NTRK3IGF1RFGFR1
SCHEMBL11477300 0.85 NTRK1 (0.60) NTRK1NTRK2NTRK3IGF1RFGFR1
SCHEMBL11475552 0.84 NTRK1 (0.44) NTRK1NTRK2NTRK3IGF1RFGFR1
Toltrazuril SCHEMBL19436333 0.81 NTRK1 (0.49) NTRK1NTRK2NTRK3IGF1RFGFR1
SCHEMBL13780159 0.81 NTRK1 (0.48) NTRK1NTRK2NTRK3IGF1RFGFR1
SCHEMBL10975351 0.80 NTRK1 (0.52) NTRK1NTRK2NTRK3IGF1RFGFR1

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
US-4219552-A AND HAVING GOOD COCCIDIOSTATIC ACTION BAYER AKTIENGESELLSCHAFT (DE) 1980-08-26 US disclosed