SCHEMBL3556780

SCHEMBL3556780

CCCC1CC(=O)N(C(CSCc2ccccc2)C(N)=O)C1

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.42
MAPT P10636 2/20 0.40
SDCBP O00560 1/20 0.39
SDC2 P34741 1/20 0.39
POLB P06746 2/20 0.38
MAPK1 P28482 1/20 0.38
TP53 P04637 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
THRB P10828 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.34
AGTR2 P50052 1/20 0.34
KDM4E B2RXH2 2/20 0.34

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
SCHEMBL3563124 0.88 EPHX1 (0.38) ALDH1A1MAPTSMN1; SMN2L3MBTL1
SCHEMBL563609 0.85 ALDH1A1 (0.46) ALDH1A1MAPTPOLBSMN1; SMN2L3MBTL1
SCHEMBL563987 0.84 TSHR (0.39) ALDH1A1POLBL3MBTL1
SCHEMBL3566688 0.84 LMNA (0.37) MAPT
SCHEMBL563742 0.81 SLC1A1 (0.39) ALDH1A1MAPTPOLBMAPK1L3MBTL1
SCHEMBL3561802 0.80 LMNA (0.35)
SCHEMBL23403931 0.80 LMNA (0.41) ALDH1A1POLBL3MBTL1
SCHEMBL563980 0.80 LMNA (0.41) ALDH1A1POLBL3MBTL1
SCHEMBL2516304 0.80 ALDH1A1 (0.40) ALDH1A1POLBSMN1; SMN2L3MBTL1
Brivaracetam SCHEMBL563970 0.79 CA1 (0.49) ALDH1A1MAPTPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7692028-B2 2-oxo-1-pyrrolidine derivatives, processes for preparing them and their uses UCB PHARMA, S.A. (BE) 2010-04-06 US disclosed
US-20080097109-A1 2-oxo-1-pyrrolidine derivatives, processes for preparing them and their uses UCB BIOPHARMA SPRL (BE) 2008-04-24 US disclosed
US-20050171187-A1 2-Oxo-1-pyrrolidine derivatives, processes for preparing them and their uses DIFFERDING EDMOND (BE) 2005-08-04 US disclosed
US-6911461-B2 For treating epilepsy, epileptogenesis, seizure disorders, convulsions, bipolar disorders, mania, depression, anxiety, migraine, neuralgia, chronic pain, neuropathic pain, cerebral ischemia, cardiac arrhythmia, myotonia, cocaine abuse UCB, S.A. (BE) 2005-06-28 US disclosed
US-6806287-B2 NEUROLOGICAL DISORDERS; SUCH AS 2-(4-(2,2-DIFLUOROVINYL)-2-OXOPYRROLIDINYL)BUTANAMIDE UCB, S.A. (BE) 2004-10-19 US 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 (2 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-20050171187-A1 2-Oxo-1-pyrrolidine derivatives, processes for preparing them and their uses CYP1B1, OGDH, CYP1A2 ALDH1A1 186/4885MAPT 957/4885SDCBP 4711/4885
US-20080097109-A1 2-oxo-1-pyrrolidine derivatives, processes for preparing them and their uses CYP1B1, OGDH, CYP1A2 ALDH1A1 186/4885MAPT 957/4885SDCBP 4711/4885

“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.