SCHEMBL10889192

SCHEMBL10889192

O=C(Cc1ccccc1)N[C@@H]1C(=O)NC1S(=O)(=O)c1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTSL P07711 1/20 0.55
CTSS P25774 1/20 0.55
CTSK P43235 1/20 0.55
EPHX2 P34913 1/20 0.44
MAPT P10636 1/20 0.43
PRMT1 Q99873 1/20 0.43
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
HDAC8 Q9BY41 1/20 0.41
HDAC6 Q9UBN7 1/20 0.41
PKM P14618 1/20 0.41
TSHR P16473 1/20 0.41
CRBN Q96SW2 1/20 0.41
EGFR P00533 4/20 0.41
ERBB2 P04626 4/20 0.41
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA5A P35218 1/20 0.41
CA7 P43166 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
SCHEMBL10895416 1.00 CTSL (0.55) CTSLCTSSCTSKEPHX2MAPT
SCHEMBL10887845 1.00 CTSL (0.55) CTSLCTSSCTSKEPHX2MAPT
SCHEMBL10895418 1.00 CTSL (0.55) CTSLCTSSCTSKEPHX2MAPT
SCHEMBL9443881 0.88 EPHX2 (0.46) CTSLCTSSCTSKEPHX2MAPT
SCHEMBL8469271 0.83 CA2 (0.43) CTSLCTSSCTSKEPHX2MAPT
SCHEMBL11203776 0.82 CTSL (0.51) CTSLCTSSCTSKMAPTMEN1
SCHEMBL10886904 0.81 CTSL (0.50) CTSLCTSSCTSKMEN1KMT2A
SCHEMBL10896800 0.81 CTSL (0.50) CTSLCTSSCTSKMEN1KMT2A
SCHEMBL8991232 0.81 CTSL (0.50) CTSLCTSSCTSKMEN1KMT2A
SCHEMBL10896823 0.81 CTSL (0.50) CTSLCTSSCTSKMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0080942-B1 NOVEL INTERMEDIATES AND PROCESS FOR PREPARING (S)-3-ACYLAMINO-4-SUBSTITUTED-2-AZETIDINONES E.R. Squibb & Sons, Inc. (US) 1986-02-26 EP disclosed
US-4421686-A 4-Norbornyl-sulfonyl azetidinone intermediates and process for preparing (S)-3-acylamino-4-substituted-2-azetidinones E. R. SQUIBB & SONS, INC. (US) 1983-12-20 US disclosed
EP-0080942-A1 Novel intermediates and process for preparing (S)-3-acylamino-4-substituted-2-azetidinones E.R. Squibb & Sons, Inc. (US) 1983-06-08 EP disclosed