SCHEMBL14028644

SCHEMBL14028644

COOC(=O)CCN(C)Cc1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.51
CARM1 Q86X55 1/20 0.49
PRMT6 Q96LA8 1/20 0.49
PRMT8 Q9NR22 1/20 0.49
ALDH1A1 P00352 1/20 0.48
ACHE P22303 1/20 0.48
NPC1 O15118 1/20 0.47
RAB9A P51151 1/20 0.47
KDM4A O75164 2/20 0.47
KDM4C Q9H3R0 2/20 0.47
TSHR P16473 1/20 0.47
SIGMAR1 Q99720 2/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
HTR7 P34969 1/20 0.46

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
SCHEMBL5522971 0.87 MEN1 (0.56) SMN1; SMN2CARM1PRMT6PRMT8ALDH1A1
SCHEMBL11559248 0.83 SMN1; SMN2 (0.52) SMN1; SMN2CARM1PRMT6PRMT8ALDH1A1
SCHEMBL14028642 0.82 KDM4E (0.55) ALDH1A1ACHETSHRL3MBTL1
SCHEMBL1303146 0.81 LTA4H (0.62) SMN1; SMN2CARM1PRMT6PRMT8ALDH1A1
SCHEMBL40675 0.80 KDM4A (0.66) SMN1; SMN2CARM1PRMT6PRMT8ACHE
SCHEMBL5479984 0.78 CARM1 (0.56) SMN1; SMN2CARM1PRMT6PRMT8ALDH1A1
SCHEMBL4802333 0.78 NPC1 (0.51) SMN1; SMN2CARM1PRMT6PRMT8ALDH1A1
SCHEMBL21908927 0.78 LTA4H (0.62) SMN1; SMN2KDM4AKDM4CSIGMAR1L3MBTL1
SCHEMBL14028641 0.77 KMT2A (0.64) TSHR
SCHEMBL13359820 0.77 CARM1 (0.59) SMN1; SMN2CARM1PRMT6PRMT8ALDH1A1

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-7432239-B2 Polyoxyalkylene compound and method for making CENTRAL MICHIGAN UNIVERSITY BOARD OF TRUSTEES (US) 2008-10-07 US disclosed