SCHEMBL10487352

SCHEMBL10487352

COCC(C)(C)C1CCNCC1

nearest known ligand 0.31

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.31
MEN1 O00255 1/20 0.31
LMNA P02545 1/20 0.31
CYP2D6 P10635 1/20 0.31
HRH1 P35367 1/20 0.31
SCN1A P35498 1/20 0.31
KMT2A Q03164 1/20 0.31
SCN2A Q99250 1/20 0.31
SCN3A Q9NY46 1/20 0.31
KCNH2 Q12809 1/20 0.30
SLC6A2 P23975 1/20 0.30
SLC6A4 P31645 1/20 0.30
SLC6A3 Q01959 1/20 0.30

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
SCHEMBL13376282 0.81 MEN1 (0.33) MEN1LMNAKMT2A
SCHEMBL26221111 0.79 NPSR1 (0.36) MEN1LMNAKMT2A
SCHEMBL21473601 0.78 ALDH1A1 (0.32) TDP1
SCHEMBL19033715 0.78 MEN1 (0.33) MEN1LMNACYP2D6HRH1SCN1A
SCHEMBL10487372 0.77 ARG1 (0.33) LMNA
SCHEMBL14212686 0.76 KDM4E (0.39) TDP1MEN1LMNACYP2D6HRH1
SCHEMBL7450744 0.74 ARG1 (0.32) MEN1LMNACYP2D6HRH1SCN1A
SCHEMBL14051676 0.74 MEN1 (0.31) MEN1LMNACYP2D6HRH1SCN1A
SCHEMBL20012662 0.74 GNAO1 (0.34) MEN1LMNACYP2D6HRH1SCN1A
SCHEMBL2674989 0.74 LMNA (0.35) MEN1LMNACYP2D6HRH1SCN1A

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
US-4871748-A RODENTICIDES MAY & BAKER LIMITED (GB) 1989-10-03 US disclosed