SCHEMBL9762037

SCHEMBL9762037

CCOCCn1c(N(C)CCN(C)C)nc2cccnc21

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SLC6A9 P48067 1/20 0.45
KDM4E B2RXH2 1/20 0.39
MEN1 O00255 1/20 0.39
TSHR P16473 1/20 0.39
KMT2A Q03164 1/20 0.39
LMNA P02545 1/20 0.37
RAB9A P51151 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
MYC P01106 1/20 0.37
ALDH1A1 P00352 1/20 0.37
HRH1 P35367 2/20 0.36
CHRM1 P11229 1/20 0.36
KCNH2 Q12809 1/20 0.36

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
SCHEMBL10444947 0.81 ALDH1A1 (0.51) SLC6A9KDM4EMEN1TSHRKMT2A
SCHEMBL9760898 0.80 SLC6A9 (0.42) SLC6A9KDM4EMEN1TSHRKMT2A
SCHEMBL9760636 0.78 RAD52 (0.43) SLC6A9KDM4EMEN1TSHRKMT2A
SCHEMBL10383193 0.77 HRH1 (0.46) SLC6A9KDM4ETSHRSMN1; SMN2ALDH1A1
SCHEMBL14263836 0.76 SLC6A9 (0.55) SLC6A9KDM4EMEN1TSHRKMT2A
SCHEMBL9634894 0.74 SLC6A9 (0.53) SLC6A9KDM4EMEN1TSHRKMT2A
SCHEMBL10384097 0.74 HTR3E (0.45) SLC6A9MEN1KMT2ALMNASMN1; SMN2
SCHEMBL10446524 0.71 ADORA2A (0.33) KDM4EKMT2ASMN1; SMN2ALDH1A1
SCHEMBL9762355 0.71
Water SCHEMBL10382579 0.70 SLC6A9 (0.42) SLC6A9KDM4EMEN1TSHRKMT2A

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-5023256-A Antihistamines DOMPE FARMACEUTICI S.P.A. (IT) 1991-06-11 US disclosed