SCHEMBL6008203

SCHEMBL6008203

O=C(Cc1ccc(Cl)c(Cl)c1)NC(Cc1ccc(Cl)cc1Cl)CN1CCC(Cc2ccccc2)CC1

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 5/20 0.50
NPFFR1 Q9GZQ6 1/20 0.46
NPFFR2 Q9Y5X5 1/20 0.46
CCR3 P51677 1/20 0.45
HTT P42858 2/20 0.44
DRD4 P21917 1/20 0.44
SLC6A2 P23975 4/20 0.44
SLC6A4 P31645 3/20 0.44
ALDH1A1 P00352 2/20 0.43
SLC6A3 Q01959 2/20 0.43
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
KDM4E B2RXH2 1/20 0.41
GLA P06280 1/20 0.41
GAA P10253 1/20 0.41
MAPT P10636 1/20 0.41
ATM Q13315 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41

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
SCHEMBL6008834 0.90 SIGMAR1 (0.56) SIGMAR1NPFFR1NPFFR2CCR3HTT
SCHEMBL6007492 0.85 SLC6A2 (0.48) SIGMAR1CCR3HTTDRD4SLC6A2
SCHEMBL6007352 0.80 SLC6A2 (0.53) SIGMAR1CCR3HTTDRD4SLC6A2
SCHEMBL6009314 0.80 SLC6A2 (0.50) SIGMAR1CCR3HTTDRD4SLC6A2
SCHEMBL6008676 0.79 CCR3 (0.61) SIGMAR1NPFFR1NPFFR2CCR3SLC6A2
SCHEMBL6009258 0.76 SIGMAR1 (0.54) SIGMAR1NPFFR1NPFFR2HTTSLC6A2
SCHEMBL6008837 0.75 SLC6A2 (0.56) SIGMAR1CCR3HTTDRD4SLC6A2
SCHEMBL6007980 0.74 CARM1 (0.52) SIGMAR1NPFFR1NPFFR2CCR3HTT
Hydrochloric Acid SCHEMBL6007340 0.74 SLC6A2 (0.55) SIGMAR1CCR3HTTDRD4SLC6A2
SCHEMBL6008656 0.74 ALDH1A1 (0.47) SIGMAR1NPFFR1NPFFR2CCR3HTT

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-7078537-B2 Phenylalkyl diamine and amide analogs SK CORPORATION (KR) 2006-07-18 US disclosed