SCHEMBL15061201

SCHEMBL15061201

CCN1CCN(c2ccc(NS(=O)(=O)c3ccc(C(C)C)cc3)cn2)C[C@@H]1C

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.53
GAA P10253 2/20 0.48
MEN1 O00255 1/20 0.48
KDM4E B2RXH2 2/20 0.46
DRD2 P14416 3/20 0.45
DRD3 P35462 3/20 0.45
KCNH2 Q12809 3/20 0.45
MAPT P10636 1/20 0.42
HTR6 P50406 1/20 0.42
MLNR O43193 1/20 0.41
KDM2B Q8NHM5 2/20 0.41
GPR119 Q8TDV5 1/20 0.40
PANK3 Q9H999 4/20 0.40
POLB P06746 1/20 0.39
ALOX12 P18054 1/20 0.39

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
Hydrochloric Acid SCHEMBL4693057 0.99 KMT2A (0.52) KMT2AGAAMEN1KDM4EDRD2
SCHEMBL15061389 0.93 KMT2A (0.53) KMT2AGAAMEN1KDM4EDRD2
SCHEMBL4688586 0.93 KMT2A (0.53) KMT2AGAAMEN1KDM4EDRD2
Hydrochloric Acid SCHEMBL4692989 0.92 KMT2A (0.52) KMT2AGAAMEN1KDM4EDRD2
SCHEMBL15061305 0.89 KMT2A (0.49) KMT2AGAAMEN1KDM4EDRD2
SCHEMBL4690903 0.89 KMT2A (0.49) KMT2AGAAMEN1KDM4EDRD2
SCHEMBL4690184 0.88 DRD2 (0.44) KMT2AKDM4EDRD2DRD3KCNH2
SCHEMBL4690178 0.88 DRD2 (0.44) KMT2AKDM4EDRD2DRD3KCNH2
Hydrochloric Acid SCHEMBL4688529 0.88 KMT2A (0.48) KMT2AGAAMEN1KDM4EDRD2
Hydrochloric Acid SCHEMBL27635996 0.87 DRD2 (0.43) KMT2AKDM4EDRD2DRD3KCNH2

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-8476275-B2 N-[piperazinyl hetaryl]arylsufonamide compounds with affinity for the dopamine D3 receptor ABBOTT GMBH & CO. KG (DE) 2013-07-02 US claimed