SCHEMBL11566580

SCHEMBL11566580

COc1cnn(-c2ccc(F)c(Cl)c2)c(=O)c1OC

nearest known ligand 0.54

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.54
KMT2A Q03164 1/20 0.54
NPSR1 Q6W5P4 2/20 0.53
LMNA P02545 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
NPBWR1 P48145 11/20 0.53
MCHR1 Q99705 7/20 0.53
GAA P10253 1/20 0.52
RAB9A P51151 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.49
EGFR P00533 1/20 0.47

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
SCHEMBL11566418 0.88 ALDH1A1 (0.52) ALDH1A1KMT2ANPSR1LMNASMN1; SMN2
SCHEMBL10508607 0.88 NPSR1 (0.67) ALDH1A1KMT2ANPSR1LMNASMN1; SMN2
SCHEMBL4176781 0.86 ALDH1A1 (0.53) ALDH1A1KMT2ANPSR1LMNASMN1; SMN2
SCHEMBL4177678 0.79 ALDH1A1 (0.46) ALDH1A1KMT2ANPSR1LMNASMN1; SMN2
SCHEMBL8212150 0.77 ALDH1A1 (0.44) ALDH1A1KMT2ANPSR1LMNASMN1; SMN2
SCHEMBL140231 0.75 GAA (0.72) ALDH1A1KMT2ANPSR1LMNASMN1; SMN2
SCHEMBL10470816 0.75 NPBWR1 (0.62) ALDH1A1KMT2ALMNASMN1; SMN2NPBWR1
SCHEMBL4188188 0.74 NPBWR1 (0.52) ALDH1A1KMT2ANPSR1LMNASMN1; SMN2
SCHEMBL10653996 0.74 GAA (0.51) ALDH1A1KMT2ANPSR1SMN1; SMN2NPBWR1
SCHEMBL11566562 0.73 NPBWR1 (0.55) ALDH1A1KMT2ASMN1; SMN2NPBWR1MCHR1

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
EP-0003805-A1 Pyridazone derivatives and herbicidal compositions containing them BASF Aktiengesellschaft (DE) 1979-09-05 EP claimed