SCHEMBL490341

SCHEMBL490341

CCOC(=O)C(C#N)C(c1ccccc1)c1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.53
L3MBTL1 Q9Y468 1/20 0.53
GAA P10253 3/20 0.52
MAPK1 P28482 1/20 0.52
MMP8 P22894 1/20 0.49
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
PIN1 Q13526 1/20 0.45
NPC1 O15118 1/20 0.44
TSHR P16473 2/20 0.42
TDP1 Q9NUW8 1/20 0.41
SLC6A2 P23975 1/20 0.41
SLC6A4 P31645 1/20 0.41
SLC6A3 Q01959 1/20 0.41

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
SCHEMBL22262872 0.86 SMN1; SMN2 (0.52) SMN1; SMN2L3MBTL1GAAMAPK1MMP8
SCHEMBL2566030 0.86 SMN1; SMN2 (0.52) SMN1; SMN2L3MBTL1GAAMAPK1MMP8
SCHEMBL27744339 0.86 SMN1; SMN2 (0.52) SMN1; SMN2L3MBTL1GAAMAPK1MMP8
SCHEMBL19388060 0.84 SMN1; SMN2 (0.51) SMN1; SMN2L3MBTL1GAAMAPK1MMP8
SCHEMBL10363351 0.84 GAA (0.45) SMN1; SMN2L3MBTL1GAAMAPK1MEN1
SCHEMBL4660065 0.84 GAA (0.46) SMN1; SMN2L3MBTL1GAAMAPK1MMP8
SCHEMBL12506132 0.83 SMN1; SMN2 (0.50) SMN1; SMN2L3MBTL1GAAMAPK1MMP8
SCHEMBL370828 0.82 GAA (0.43) SMN1; SMN2L3MBTL1GAAMAPK1MEN1
SCHEMBL370827 0.81 GAA (0.43) SMN1; SMN2L3MBTL1GAAMAPK1MMP8
SCHEMBL28464413 0.81 KMT2A (0.50) SMN1; SMN2GAAMAPK1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4333985-B1 MODULATORS OF TREX1 CONSTELLATION PHARMACEUTICALS INC (US) 2025-07-30 EP disclosed
US-20240262814-A1 MODULATORS OF TREX1 CONSTELLATION PHARMACEUTICALS, INC. 2024-08-08 US disclosed
EP-4333985-A1 MODULATORS OF TREX1 Constellation Pharmaceuticals, Inc. (US) 2024-03-13 EP disclosed
CN-117561251-A Modulators of TREX1 星座制药公司 2024-02-13 CN disclosed
CN-116547207-A Antibacterial and antiviral molded body and master batch 三井化学东赛璐株式会社 2023-08-04 CN disclosed
WO-2022235725-A1 MODULATORS OF TREX1 CONSTELLATION PHARMACEUTICALS, INC. (US) 2022-11-10 WO disclosed
US-20220144712-A1 SHAPED ARTIFICIAL POLYMER ARTICLES BASF SE (DE) 2022-05-12 US disclosed
US-9263870-B2 System and method for applying an adhesive coated cable to a surface COMMSCOPE TECHNOLOGIES LLC (US) 2016-02-16 US disclosed
US-20140150971-A1 System and Method for Applying an Adhesive Coated Cable to a Surface ARRIS SOLUTIONS, INC. 2014-06-05 US disclosed
US-8268293-B2 Using compounds which do not themselves exhibit significant UV absorption in the UV-A or UV-B region, but are reactive under use conditions, such as 4-hydroxyphenylpropionic acid, or 2-ethylhexyl 4-hydroxy-3,5-dimethoxycinnamate, or polysiloxanes which contain benzylidenemalonic acid derivatives MERCK PATENT GMBH (DE) 2012-09-18 US disclosed
US-8106233-B2 Applying di-2-ethylhexyl 4-hydroxy-3,5-dimethoxy-benzylmalonate; protective action against UV rays, oxidative stress on body cells, counters skin ageing MERCK PATENT GMBH (DE) 2012-01-31 US disclosed
US-20080171004-A1 Using compounds which do not themselves exhibit significant UV absorption in the UV-A or UV-B region, but are reactive under use conditions, such as 4-hydroxyphenylpropionic acid, or 2-ethylhexyl 4-hydroxy-3,5-dimethoxycinnamate, or polysiloxanes which contain benzylidenemalonic acid derivatives MERCK PATENT GMBH (DE) 2008-07-17 US disclosed
US-20080152603-A1 Antioxidants SUSONITY Commercial GmbH (DE) 2008-06-26 US disclosed
EP-1871339-A1 UV PROTECTION Merck Patent GmbH (DE) 2008-01-02 EP disclosed
EP-1871735-A1 ANTIOXIDANTS Merck Patent GmbH (DE) 2008-01-02 EP disclosed
WO-2006111233-A1 ANTIOXIDANTS MERCK PATENT GMBH (DE) 2006-10-26 WO disclosed
WO-2006111234-A1 UV PROTECTION MERCK PATENT GMBH (DE) 2006-10-26 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080152603-A1 Antioxidants GPX4, GPX1, CAT SMN1; SMN2 1624/4885L3MBTL1 4336/4885GAA 940/4885
US-20240262814-A1 MODULATORS OF TREX1 CFTR, SLC10A1, CYP27A1 SMN1; SMN2 222/4885L3MBTL1 3434/4885GAA 129/4885
US-20080171004-A1 Using compounds which do not themselves exhibit significant UV absorption in the UV-A or UV-B region, but are reactive under use conditions, such as 4-hydroxyphenylpropionic acid, or 2-ethylhexyl 4-hydroxy-3,5-dimethoxycinnamate, or polysiloxanes which contain benzylidenemalonic acid derivatives HPD, HAAO, UGT1A6 SMN1; SMN2 4479/4885L3MBTL1 3978/4885GAA 309/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.