SCHEMBL15313234

SCHEMBL15313234

CCC(C)=C(C(=O)NC)c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES1 P23141 4/20 0.44
CES2 O00748 3/20 0.44
MAPT P10636 3/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
HPGD P15428 2/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
KDM4E B2RXH2 1/20 0.41
CYP3A4 P08684 1/20 0.41
ALOX15 P16050 1/20 0.41
MAPK1 P28482 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
POLB P06746 2/20 0.41
ATM Q13315 2/20 0.41
RAB9A P51151 2/20 0.40
ALDH1A1 P00352 2/20 0.40
TSHR P16473 1/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
NPC1 O15118 1/20 0.38
LMNA P02545 1/20 0.38

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
SCHEMBL9818141 0.81 CES1 (0.50) CES1CES2MAPTSMN1; SMN2HPGD
SCHEMBL8158420 0.81 CES1 (0.50) CES1CES2MAPTSMN1; SMN2HPGD
SCHEMBL12242104 0.79 TSHR (0.47) CES1CES2MAPTSMN1; SMN2HPGD
SCHEMBL8059852 0.77 TSHR (0.43) CES1CES2MAPTSMN1; SMN2HPGD
SCHEMBL27597205 0.75 POLB (0.41) CES1CES2MAPTSMN1; SMN2HPGD
SCHEMBL1694140 0.74 CES2 (0.59) CES1CES2MAPTSMN1; SMN2HPGD
SCHEMBL4666678 0.70 TSHR (0.48) CES1CES2MAPTSMN1; SMN2HPGD
Propiophenone SCHEMBL28552557 0.69 MAPT (0.62) CES1CES2MAPTSMN1; SMN2HPGD
Propiophenone SCHEMBL9364510 0.69 MAPT (0.67) CES1CES2MAPTSMN1; SMN2HPGD
SCHEMBL18878905 0.68 TSHR (0.42) CES1CES2MAPTSMN1; SMN2HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240189303-A1 METHODS AND COMPOSITIONS FOR PREVENTION AND TREATMENT OF CARDIAC HYPERTROPHY UNIVERSITY OF HAWAII 2024-06-13 US disclosed
US-20190192508-A1 METHODS AND COMPOSITIONS FOR PREVENTION AND TREATMENT OF CARDIAC HYPERTROPHY UNIV HAWAII (US) 2019-06-27 US disclosed
US-10137123-B2 Methods and compositions for prevention and treatment of cardiac hypertrophy UNIVERSITY OF HAWAII (US) 2018-11-27 US disclosed
US-20170231982-A1 METHODS AND COMPOSITIONS FOR PREVENTION AND TREATMENT OF CARDIAC HYPERTROPHY UNIVERSITY OF HAWAII 2017-08-17 US disclosed
US-20150352105-A1 METHODS AND COMPOSITIONS FOR PREVENTION AND TREATMENT OF CARDIAC HYPERTROPHY NATIONAL INSTITUTES OF HEALTH - DIRECTOR DEITR 2015-12-10 US disclosed
US-9084786-B2 Methods and compositions for prevention and treatmentof cardiac hypertrophy UNIVERSITY OF HAWAII (US) 2015-07-21 US disclosed
US-20130274271-A1 METHODS AND COMPOSITIONS FOR PREVENTION AND TREATMENTOF CARDIAC HYPERTROPHY UNIVERSITY OF HAWAII (US) 2013-10-17 US disclosed