SCHEMBL2552780

SCHEMBL2552780

C=CC(=O)C(C)C(=O)OC

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.40
SMN1; SMN2 Q16637 2/20 0.39
CA14 Q9ULX7 2/20 0.37
KMT2A Q03164 4/20 0.36
MEN1 O00255 3/20 0.36
CA12 O43570 1/20 0.34
ALDH1A1 P00352 3/20 0.33
TAS1R3 Q7RTX0 1/20 0.32
TAS1R1 Q7RTX1 1/20 0.32
KEAP1 Q14145 1/20 0.31
NFE2L2 Q16236 1/20 0.31
HCAR2 Q8TDS4 1/20 0.31
MMP2 P08253 1/20 0.31
MMP9 P14780 1/20 0.31
MMP13 P45452 1/20 0.31
HPGD P15428 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
SCHEMBL30540966 0.78 MMP2 (0.43) TSHRSMN1; SMN2CA14KMT2AMEN1
SCHEMBL275280 0.76 SMN1; SMN2 (0.52) TSHRSMN1; SMN2CA14KMT2ACA12
SCHEMBL10720609 0.74 SMN1; SMN2 (0.36) TSHRSMN1; SMN2CA14KMT2AMEN1
SCHEMBL27856678 0.74 TSHR (0.52) TSHRSMN1; SMN2ALDH1A1HPGD
SCHEMBL26658220 0.73 SMN1; SMN2 (0.50) TSHRSMN1; SMN2CA14KMT2ACA12
SCHEMBL10805452 0.73 SMN1; SMN2 (0.50) TSHRSMN1; SMN2CA14KMT2ACA12
SCHEMBL306506 0.72
SCHEMBL1842247 0.72
Acrylic Acid SCHEMBL28768519 0.71 LMNA (0.48) TSHRSMN1; SMN2CA14KMT2AMEN1
SCHEMBL5613227 0.71 TSHR (0.58) TSHRSMN1; SMN2ALDH1A1HCAR2HPGD

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
CN-121577789-A Method for detecting 2-propyl-4-pentenoic acid in anti-epileptic drug valproic acid 湖南省湘中制药有限公司 2026-02-27 CN disclosed
EP-2553145-B1 ETCH RESISTANT ALUMINA BASED COATINGS PIBOND OY (FI) 2022-09-21 EP disclosed
US-20170200615-A1 ETCH RESISTANT ALUMINA BASED COATINGS PIBOND (ZHEJIANG) NEW MATERIALS CO., LTD (CN) 2017-07-13 US disclosed
US-9564339-B2 Etch resistant alumina based coatings PIBOND OY (FI) 2017-02-07 US disclosed
US-20130143408-A1 ETCH RESISTANT ALUMINA BASED COATINGS SILECS OY (FI) 2013-06-06 US disclosed
EP-2553145-A1 ETCH RESISTANT ALUMINA BASED COATINGS Silecs OY (FI) 2013-02-06 EP disclosed
WO-2011121166-A1 ETCH RESISTANT ALUMINA BASED COATINGS SILECS OY (FI) 2011-10-06 WO disclosed