SCHEMBL8233183

SCHEMBL8233183

CCC(=O)N1CCN(c2ccc(Cl)cn2)CC1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ME2 P23368 3/20 0.57
ME1 P48163 3/20 0.57
ME3 Q16798 3/20 0.57
PANK3 Q9H999 1/20 0.56
CKS1B P61024 1/20 0.54
SKP1 P63208 1/20 0.54
SKP2 Q13309 1/20 0.54
TRPV1 Q8NER1 3/20 0.52
LMNA P02545 1/20 0.51
MAPT P10636 1/20 0.51
MAPK1 P28482 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
CHRM1 P11229 1/20 0.51
DRD2 P14416 4/20 0.50
TSHR P16473 1/20 0.50
DRD4 P21917 3/20 0.49
HTR1A P08908 1/20 0.48
HTR2A P28223 1/20 0.48
HTR2C P28335 1/20 0.48
HTR7 P34969 1/20 0.48

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
SCHEMBL1904981 0.87 ME2 (0.58) ME2ME1ME3PANK3CKS1B
SCHEMBL18711280 0.84 PANK3 (0.60) ME2ME1ME3PANK3CKS1B
SCHEMBL27519720 0.83 AKR1C3 (0.61) ME2ME1ME3PANK3CKS1B
SCHEMBL3629277 0.83 CKS1B (0.54) ME2ME1ME3PANK3CKS1B
SCHEMBL16397570 0.82 PANK3 (0.57) ME2ME1ME3PANK3TRPV1
SCHEMBL18701794 0.80 PANK3 (0.56) ME2ME1ME3PANK3CKS1B
SCHEMBL17547308 0.80 SMN1; SMN2 (0.73) PANK3LMNAMAPTSMN1; SMN2
SCHEMBL15014105 0.80 PANK3 (0.67) PANK3CHRM1
SCHEMBL21522073 0.78 PANK3 (0.54) ME2ME1ME3PANK3TRPV1
SCHEMBL21522399 0.77 TIPARP (0.62) ME2ME1ME3PANK3LMNA

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2010146083-A1 ANTHELMINTIC AGENTS AND THEIR USE INTERVET INTERNATIONAL B.V. (NL) 2010-12-23 WO disclosed
WO-2007087135-A2 PIPERAZINES AND PIPERIDINES AS mGluR5 POTENTIATORS ASTRAZENECA AB (SE) 2007-08-02 WO disclosed