SCHEMBL20154762

SCHEMBL20154762

C=C(CS(=O)(=O)c1ccc(C)cc1)C(=O)OCc1cc#ccc1

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.42
LMNA P02545 2/20 0.41
GAA P10253 1/20 0.40
MAPT P10636 3/20 0.39
KMT2A Q03164 3/20 0.39
RECQL P46063 1/20 0.39
CA2 P00918 1/20 0.37
CA9 Q16790 1/20 0.37
HSD17B10 Q99714 1/20 0.36
HSD11B1 P28845 1/20 0.36

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
SCHEMBL20145385 0.82 LMNA (0.61) ALDH1A1LMNAGAAMAPTKMT2A
SCHEMBL17424792 0.78 ALDH1A1 (0.54) ALDH1A1LMNAGAAMAPTKMT2A
SCHEMBL17424803 0.75 ALDH1A1 (0.50) ALDH1A1LMNAMAPTKMT2ARECQL
SCHEMBL17424797 0.75 ALDH1A1 (0.50) ALDH1A1LMNAMAPTKMT2ARECQL
SCHEMBL17424790 0.75 ALDH1A1 (0.50) ALDH1A1LMNAMAPTKMT2ARECQL
SCHEMBL20145427 0.75 ALDH1A1 (0.50) ALDH1A1LMNAMAPTKMT2ARECQL
SCHEMBL30159652 0.74 ALDH1A1 (0.49) ALDH1A1LMNAMAPTKMT2ARECQL
SCHEMBL28297415 0.72 KMT2A (0.48) ALDH1A1LMNAMAPTKMT2ACA2
SCHEMBL23095597 0.71 ALDH1A1 (0.46) ALDH1A1LMNAGAAMAPTKMT2A
SCHEMBL17424801 0.71 TSHR (0.47) ALDH1A1LMNAMAPTKMT2ARECQL

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-3321331-B1 SOLDER MASK INKJET INKS FOR MANUFACTURING PRINTED CIRCUIT BOARDS AGFA GEVAERT (BE) 2020-10-21 EP disclosed
WO-2018087059-A1 SOLDER MASK INKJET INKS FOR MANUFACTURING PRINTED CIRCUIT BOARDS AGFA-GEVAERT N.V. (BE) 2018-05-17 WO disclosed