SCHEMBL29323696

SCHEMBL29323696

C=CC(=O)OCCS(=O)(=O)c1ccncc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 2/20 0.42
MMP1 P03956 1/20 0.41
TSHR P16473 6/20 0.41
ALDH1A1 P00352 4/20 0.41
TP53 P04637 2/20 0.41
HIF1A Q16665 2/20 0.41
CYP3A4 P08684 2/20 0.41
HSD17B10 Q99714 1/20 0.41
KMT2A Q03164 2/20 0.38
NPC1 O15118 1/20 0.38
HPGD P15428 1/20 0.38
SNCA P37840 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.33
HTT P42858 2/20 0.33
MEN1 O00255 1/20 0.33
LMNA P02545 1/20 0.33
GAA P10253 1/20 0.33
CYP2D6 P10635 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32

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
SCHEMBL28734421 0.84 THRB (0.55) THRBTSHRALDH1A1TP53HIF1A
SCHEMBL9464166 0.83 KMT2A (0.45) THRBTSHRALDH1A1TP53HIF1A
SCHEMBL11044833 0.82 ALDH1A1 (0.50) ALDH1A1CYP3A4KMT2ALMNAGAA
SCHEMBL29323762 0.78 SNCA (0.50) MMP1TSHRALDH1A1KMT2ASNCA
SCHEMBL2874512 0.75 TSHR (0.52) THRBTSHRALDH1A1TP53HIF1A
SCHEMBL9555298 0.75 TSHR (0.47) THRBTSHRALDH1A1TP53HIF1A
SCHEMBL3942397 0.74 ALDH1A1 (0.51) THRBALDH1A1TP53CYP3A4HSD17B10
SCHEMBL28625109 0.74 THRB (0.38) THRBTSHRALDH1A1TP53HIF1A
SCHEMBL1224388 0.74 TSHR (0.50) THRBTSHRALDH1A1TP53HIF1A
Pyridine SCHEMBL1255050 0.74 THRB (0.43) THRBTSHRALDH1A1TP53HIF1A

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
US-20240241440-A1 POLYMER, PHOTORESIST COMPOSITIONS INCLUDING THE SAME, AND PATTERN FORMATION METHODS U.S. BANK TRUST COMPANY, NATIONAL ASSOCIATION, AS NOTES COLLATERAL AGENT 2024-07-18 US disclosed
US-20240241440-A1 POLYMER, PHOTORESIST COMPOSITIONS INCLUDING THE SAME, AND PATTERN FORMATION METHODS U.S. BANK TRUST COMPANY, NATIONAL ASSOCIATION, AS NOTES COLLATERAL AGENT 2024-07-18 US disclosed