SCHEMBL8556418

SCHEMBL8556418

Cc1nn(C2CCN(Cc3ccccc3)CC2)c(NC(=O)NS(=O)(=O)c2ccc(Cl)cc2)c1C#N

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 5/20 0.49
ALDH1A1 P00352 1/20 0.48
CYP2D6 P10635 1/20 0.48
HTT P42858 1/20 0.48
THRB P10828 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.43
ACHE P22303 1/20 0.42
STS P08842 3/20 0.42
P2RY12 Q9H244 1/20 0.40
P2RX7 Q99572 1/20 0.40

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
SCHEMBL8553207 0.87 P2RY12 (0.42) NR3C1ALDH1A1THRBSMN1; SMN2STS
SCHEMBL8554113 0.84 FPR1 (0.47) NR3C1ALDH1A1THRBSMN1; SMN2P2RY12
SCHEMBL1984012 0.78 NTRK1 (0.48) ALDH1A1HTTSMN1; SMN2
SCHEMBL8555714 0.78 NR3C1 (0.45) NR3C1ACHEP2RX7
SCHEMBL8554531 0.76 MAPT (0.43) ALDH1A1THRBSMN1; SMN2P2RY12
SCHEMBL8553758 0.76 ALDH1A1 (0.46) ALDH1A1HTTTHRBSMN1; SMN2P2RY12
SCHEMBL8552593 0.74 MAPT (0.41) NR3C1ALDH1A1THRBSMN1; SMN2P2RY12
SCHEMBL8555738 0.74 TDP1 (0.44) NR3C1ALDH1A1THRBSMN1; SMN2P2RY12
SCHEMBL8553085 0.73 ALDH1A1 (0.43) ALDH1A1THRBSMN1; SMN2P2RY12
SCHEMBL8554183 0.72 TSHR (0.58) ACHE

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-0885890-A1 SULFONYLUREIDOPYRAZOLE DERIVATIVES SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1998-12-23 EP disclosed