SCHEMBL8604263

SCHEMBL8604263

NC(=O)NCCOCc1ccccc1

nearest known ligand 0.63

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.63
HTT P42858 2/20 0.63
LMNA P02545 1/20 0.61
ASAH1 Q13510 2/20 0.51
TSHR P16473 1/20 0.47
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45
BCAT2 O15382 1/20 0.45
CA2 P00918 1/20 0.44
ALDH1A1 P00352 1/20 0.44
L3MBTL1 Q9Y468 2/20 0.43
MAPT P10636 1/20 0.43
PARP10 Q53GL7 1/20 0.42
SLC1A1 P43005 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
SCHEMBL7337026 0.87 SMN1; SMN2 (0.60) SMN1; SMN2HTTLMNAASAH1TSHR
SCHEMBL4769824 0.86 SMN1; SMN2 (0.67) SMN1; SMN2HTTLMNAASAH1TSHR
SCHEMBL8760991 0.83 SMN1; SMN2 (0.60) SMN1; SMN2HTTLMNAASAH1TSHR
SCHEMBL28044037 0.83 SMN1; SMN2 (0.46) SMN1; SMN2HTTLMNAASAH1RAB9A
SCHEMBL8914641 0.83 SMN1; SMN2 (0.63) SMN1; SMN2HTTLMNAASAH1TSHR
SCHEMBL18626198 0.83 SMN1; SMN2 (0.63) SMN1; SMN2HTTLMNAASAH1TSHR
SCHEMBL11505841 0.83 SMN1; SMN2 (0.55) SMN1; SMN2HTTLMNAASAH1TSHR
SCHEMBL7332230 0.83 SMN1; SMN2 (0.63) SMN1; SMN2HTTLMNAASAH1TSHR
SCHEMBL11419619 0.82 TSHR (0.50) SMN1; SMN2HTTLMNATSHRNPC1
SCHEMBL1577945 0.81 SMN1; SMN2 (0.75) SMN1; SMN2HTTLMNANPC1RAB9A

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3702352-A1 PYRIMIDINEDIONE COMPOUND AGAINST CARDIAC CONDITIONS Myokardia, Inc. (US) 2020-09-02 EP disclosed
US-5789425-A Imidazolidinone derivatives, their acid adducts and therapeutic drugs for senile dementia KYORIN PHARMACEUTICAL CO., LTD. (JP) 1998-08-04 US disclosed