SCHEMBL9054133

SCHEMBL9054133

C=CCN1C(=O)CSC1=NNC(=S)NC#CC

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 4/20 0.45
▸ MAPK1 P28482 2/20 0.42
▸ TSHR P16473 1/20 0.42
▸ MAPT P10636 3/20 0.41
▸ RECQL P46063 2/20 0.39
▸ ALDH1A1 P00352 1/20 0.35
▸ POLB P06746 2/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ USP2 O75604 1/20 0.34
▸ THRB P10828 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ HSD17B10 Q99714 1/20 0.34
▸ BLM P54132 1/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ CYP1A2 P05177 1/20 0.34
▸ CYP3A4 P08684 1/20 0.34
▸ CYP2D6 P10635 1/20 0.34
▸ CYP2C19 P33261 1/20 0.34
▸ NPSR1 Q6W5P4 1/20 0.34
▸ KDM4E B2RXH2 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
SCHEMBL29780034 0.87 LMNA (0.49) LMNAMAPK1TSHRMAPTRECQL
SCHEMBL12186945 0.87 LMNA (0.49) LMNAMAPK1TSHRMAPTRECQL
SCHEMBL9053874 0.87 LMNA (0.49) LMNAMAPK1TSHRMAPTRECQL
SCHEMBL9053850 0.81 LMNA (0.48) LMNAMAPK1TSHRMAPTRECQL
SCHEMBL9053600 0.70 LMNA (0.35) LMNAMAPTALDH1A1MEN1KMT2A
SCHEMBL9054126 0.70 LMNA (0.36) LMNAMAPTALDH1A1POLBKMT2A
SCHEMBL11819614 0.70 LMNA (0.61) LMNAMAPK1TSHRMAPTRECQL
SCHEMBL11819609 0.70 LMNA (0.61) LMNAMAPK1TSHRMAPTRECQL
SCHEMBL9053194 0.69 EGFR (0.40) LMNAMAPTALDH1A1POLBKMT2A
SCHEMBL16123024 0.68 LMNA (0.50) LMNAMAPK1TSHRMAPTRECQL

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
EP-0508955-B1 Use of 2-iminothiazolidin-4-one derivatives as new medicaments CIBA GEIGY AG (CH) 1996-06-19 — — EP claimed
US-5229405-A Rheumatic diseases CIBA-GEIGY CORPORATION (US) 1993-07-20 — — US disclosed
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