SCHEMBL6007927

SCHEMBL6007927

NC(Cc1ccc(Cl)c(Cl)c1)CN1CCC(C(=O)c2ccc(Cl)c(Cl)c2)CC1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 1/20 0.57
S1PR5 Q9H228 2/20 0.53
KDM2B Q8NHM5 1/20 0.47
HSD11B1 P28845 1/20 0.46
DPP4 P27487 3/20 0.46
DPP7 Q9UHL4 2/20 0.46
CCR3 P51677 1/20 0.46
SMN1; SMN2 Q16637 2/20 0.45
KDM4E B2RXH2 1/20 0.45
ALDH1A1 P00352 1/20 0.45
SLC6A4 P31645 1/20 0.43
SLC6A3 Q01959 1/20 0.43
FAP Q12884 1/20 0.43
DPP8 Q6V1X1 1/20 0.43
DPP9 Q86TI2 1/20 0.43
CA12 O43570 1/20 0.42
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
CA9 Q16790 1/20 0.42
FPR2 P25090 1/20 0.42

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
SCHEMBL6009354 0.93 KCNH2 (0.61) KCNH2S1PR5KDM2BHSD11B1CCR3
SCHEMBL6009253 0.91 KCNH2 (0.55) KCNH2S1PR5DPP4DPP7SMN1; SMN2
SCHEMBL6007910 0.91 KCNH2 (0.50) KCNH2S1PR5KDM2BHSD11B1SLC6A4
SCHEMBL6810252 0.81 KCNH2 (0.51) KCNH2S1PR5KDM2BHSD11B1CCR3
SCHEMBL5790034 0.80 KCNH2 (0.52) KCNH2S1PR5KDM2BHSD11B1DPP4
SCHEMBL6007909 0.78 MGLL (0.54) KCNH2MEN1KMT2AHTR2A
SCHEMBL6009245 0.78 MGLL (0.54) KCNH2MEN1KMT2AHTR2AHTR2C
SCHEMBL6007347 0.76 MGLL (0.59) KCNH2SMN1; SMN2MEN1KMT2A
SCHEMBL5757243 0.76 POLB (0.59) DPP4DPP7SMN1; SMN2
Hydrochloric Acid SCHEMBL6007900 0.76 POLB (0.55) DPP4DPP7SMN1; 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