SCHEMBL9156151

SCHEMBL9156151

CC(C)CNc1cc(Cl)nc(N)[n+]1[O-]

nearest known ligand 0.42

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 5/20 0.42
HRH4 Q9H3N8 8/20 0.35
IDH1 O75874 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
ESR2 Q92731 1/20 0.31

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
SCHEMBL8599188 0.83 KMT2A (0.33) SMN1; SMN2
SCHEMBL8602832 0.80 MAPT (0.38) HRH4SMN1; SMN2
SCHEMBL8600332 0.80 GAA (0.32) HRH4TDP1
SCHEMBL8597239 0.78 TLR8 (0.40) SMN1; SMN2
SCHEMBL8598413 0.77
SCHEMBL14269189 0.77 CYP2D6 (0.50) HRH4SMN1; SMN2
SCHEMBL7117925 0.75 KMT2A (0.38)
SCHEMBL7118888 0.75 KMT2A (0.38)
SCHEMBL7126475 0.75 KMT2A (0.38)
SCHEMBL14463130 0.74 CYP2D6 (0.31)

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-5466694-A Hair growth regulators L'OREAL (FR) 1995-11-14 US disclosed