SCHEMBL3871844

SCHEMBL3871844

CCOc1cc(CN2CCC(N)CC2)ccc1C

nearest known ligand 0.56

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SSTR5 P35346 7/20 0.56
KDM4E B2RXH2 6/20 0.49
ALDH1A1 P00352 6/20 0.49
TSHR P16473 1/20 0.49
TDP1 Q9NUW8 1/20 0.47
HTR7 P34969 1/20 0.44
KMT2A Q03164 1/20 0.44
SSTR1 P30872 1/20 0.43
HRH1 P35367 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
CCR5 P51681 1/20 0.42
MAPT P10636 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
SCHEMBL3883346 0.85 SSTR5 (0.55) SSTR5KDM4EALDH1A1TSHRTDP1
SCHEMBL1748416 0.85 ALDH1A1 (0.58) SSTR5KDM4EALDH1A1KMT2AHRH1
SCHEMBL1748320 0.85 SSTR5 (0.55) SSTR5KDM4EALDH1A1TSHRTDP1
SCHEMBL29087391 0.85 KDM4E (0.68) SSTR5KDM4EALDH1A1TSHRTDP1
SCHEMBL3872371 0.81 SSTR5 (0.52) SSTR5KDM4EALDH1A1TSHR
SCHEMBL3876136 0.80 SSTR5 (0.58) SSTR5
SCHEMBL3872726 0.80 SSTR5 (0.44) SSTR5KDM4EALDH1A1TSHRTDP1
SCHEMBL17967832 0.79 KDM4E (0.58) KDM4EALDH1A1TSHRTDP1KMT2A
SCHEMBL6946467 0.79 SMN1; SMN2 (0.50) KDM4EALDH1A1HTR7KMT2ASMN1; SMN2
SCHEMBL8109264 0.79 SMN1; SMN2 (0.50) KDM4EALDH1A1HTR7KMT2ASMN1; 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1893603-B1 PIPERIDIN-4-YL-AMIDE DERIVATIVES AND THEIR USE AS SST RECEPTOR SUBTYPE 5 ANTAGONISTS HOFFMANN LA ROCHE (CH) 2009-10-14 EP disclosed