SCHEMBL28700710

SCHEMBL28700710

CC1CCN(CN(CN2CCC(C)CC2)S(=O)(=O)c2ccccc2)CC1

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ ACHE P22303 3/20 0.49
▸ HTR7 P34969 3/20 0.48
▸ HTR2A P28223 2/20 0.46
▸ HTR2C P28335 1/20 0.46
▸ DRD2 P14416 1/20 0.44
▸ HTR1D P28221 1/20 0.44
▸ DRD3 P35462 1/20 0.44
▸ NPC1 O15118 1/20 0.44
▸ RAB9A P51151 1/20 0.44
▸ SIGMAR1 Q99720 3/20 0.43
▸ KMT2A Q03164 3/20 0.42
▸ KDM4E B2RXH2 1/20 0.42
▸ MEN1 O00255 1/20 0.42
▸ ALDH1A1 P00352 1/20 0.42
▸ HTT P42858 1/20 0.42
▸ GRM5 P41594 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
SCHEMBL28704386 0.85 LMNA (0.47) HTR7HTR2AHTR2CKMT2AALDH1A1
SCHEMBL28700707 0.84 CCR5 (0.54) HTR7DRD2
SCHEMBL28713850 0.78 MEN1 (0.56) NPC1RAB9AKMT2AKDM4EMEN1
SCHEMBL28712272 0.77 HTR7 (0.51) HTR7HTR2AHTR2CDRD2SIGMAR1
SCHEMBL14375268 0.74 MEN1 (0.63) ACHEHTR7HTR2AHTR2CSIGMAR1
SCHEMBL4456846 0.72 HTR7 (0.58) ACHEHTR7DRD2HTR1DDRD3
SCHEMBL28704401 0.72 HTR7 (0.60) HTR7HTR2AHTR2CDRD2KMT2A
SCHEMBL5440416 0.71 HTR7 (0.56) ACHEHTR7DRD2HTR1DDRD3
SCHEMBL762416 0.70 KMT2A (0.74) KMT2AKDM4EMEN1ALDH1A1
SCHEMBL6530187 0.69 ACHE (0.63) ACHEHTR7HTR2ADRD2KDM4E

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
CN-114163401-A Preparation method and application of N-benzenesulfonyl formamidine compound 商丘师范学院 2022-03-11 — — CN disclosed
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