SCHEMBL6009253

SCHEMBL6009253

NC(Cc1ccc(Cl)c(Cl)c1)CN1CCC(C(=O)c2ccccc2)CC1

nearest known ligand 0.55

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 2/20 0.55
S1PR5 Q9H228 2/20 0.51
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
HTR2A P28223 1/20 0.49
SIGMAR1 Q99720 2/20 0.45
DPP4 P27487 1/20 0.44
DPP7 Q9UHL4 1/20 0.44
KDM4E B2RXH2 1/20 0.43
ALDH1A1 P00352 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
MGLL Q99685 1/20 0.43
CHRM2 P08172 1/20 0.43
CHRM3 P20309 1/20 0.43

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
SCHEMBL6007927 0.91 KCNH2 (0.57) KCNH2S1PR5MEN1KMT2AHTR2A
SCHEMBL6007910 0.89 KCNH2 (0.50) KCNH2S1PR5HTR2ASIGMAR1CHRM2
SCHEMBL6007909 0.88 MGLL (0.54) KCNH2MEN1KMT2AHTR2AMGLL
SCHEMBL6007356 0.86 HTR2A (0.61) KCNH2MEN1KMT2AHTR2AKDM4E
SCHEMBL6009354 0.85 KCNH2 (0.61) KCNH2S1PR5MEN1KMT2AKDM4E
SCHEMBL6009245 0.83 MGLL (0.54) KCNH2MEN1KMT2AHTR2AMGLL
SCHEMBL6009242 0.80 MEN1 (0.57) KCNH2MEN1KMT2AHTR2A
SCHEMBL6009428 0.80 ALDH1A1 (0.53) MEN1KMT2ASIGMAR1KDM4EALDH1A1
Hydrochloric Acid SCHEMBL6007421 0.79 ALDH1A1 (0.52) MEN1KMT2ASIGMAR1KDM4EALDH1A1
SCHEMBL3838687 0.79 HTR2A (0.61) HTR2AKDM4ESMN1; SMN2

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