SCHEMBL7557018

SCHEMBL7557018

[CH2]CN1CCN(S(=O)(=O)c2c(C)noc2C)CC1

nearest known ligand 0.66

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.58
MAPK1 P28482 1/20 0.57
MEN1 O00255 1/20 0.55
KMT2A Q03164 1/20 0.55
CHRM4 P08173 4/20 0.54
TSHR P16473 2/20 0.53
LMNA P02545 1/20 0.53
ALDH1A1 P00352 2/20 0.49
HPGD P15428 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
ABL1 P00519 1/20 0.48
BCR P11274 1/20 0.48
CHRM2 P08172 1/20 0.47
CHRM5 P08912 1/20 0.47
CHRM1 P11229 1/20 0.47
CHRM3 P20309 1/20 0.47
POLB P06746 1/20 0.46
GAA P10253 1/20 0.45

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
SCHEMBL20507216 0.81 CHRM4 (0.66) HTTMAPK1MEN1KMT2ACHRM4
SCHEMBL4182416 0.78 MAPK1 (0.62) HTTMAPK1MEN1KMT2ACHRM4
SCHEMBL4001173 0.77 MAPK1 (0.61) HTTMAPK1MEN1KMT2ACHRM4
SCHEMBL18711906 0.77 MAPK1 (0.60) HTTMAPK1MEN1KMT2ACHRM4
SCHEMBL18702273 0.73 SMN1; SMN2 (0.55) HTTMAPK1MEN1KMT2ACHRM4
SCHEMBL26106993 0.73 MAPK1 (0.60) HTTMAPK1MEN1KMT2ACHRM4
SCHEMBL14825371 0.72 HTT (0.56) HTTMAPK1MEN1KMT2ACHRM4
SCHEMBL13034821 0.72 LMNA (0.58) HTTMAPK1MEN1KMT2ACHRM4
SCHEMBL17007428 0.70 SMN1; SMN2 (0.67) HTTMAPK1MEN1KMT2ACHRM4
SCHEMBL27750094 0.69 LMNA (0.57) HTTMAPK1MEN1KMT2ACHRM4

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
WO-2002020437-A2 BASIC COMPOUNDS CONTAINING TERTIARY AMIDES WITH ACTIVITY ON TACHYKININ RECEPTORS, AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM MENARINI RICERCHE S.P.A. (IT) 2002-03-14 WO disclosed