SCHEMBL10551844

SCHEMBL10551844

Cc1cc(NS(=O)(=O)NC(=O)N2C[C@H](NC(=O)C(C(=O)O)c3ccccc3)C2=O)no1

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 2/20 0.42
▸ MEN1 O00255 1/20 0.42
▸ KLK7 P49862 10/20 0.38
▸ LMNA P02545 1/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ TSHR P16473 2/20 0.36
▸ MAPK1 P28482 1/20 0.36
▸ PPIA P62937 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ L3MBTL1 Q9Y468 1/20 0.35

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
SCHEMBL10551840 1.00 KMT2A (0.42) KMT2AMEN1KLK7LMNASMN1; SMN2
SCHEMBL10547432 0.91 KMT2A (0.42) KMT2AMEN1KLK7LMNASMN1; SMN2
SCHEMBL10545815 0.90 KMT2A (0.42) KMT2AMEN1KLK7LMNASMN1; SMN2
SCHEMBL10414813 0.85 CYP3A4 (0.31) KMT2AMAPK1ALDH1A1
SCHEMBL10414814 0.85 CYP3A4 (0.31) KMT2AMAPK1ALDH1A1
SCHEMBL10547616 0.84 GAPDH (0.40) KMT2AALDH1A1
SCHEMBL10548246 0.83 GAPDH (0.40) KMT2AALDH1A1
SCHEMBL10546713 0.81 CASP1 (0.38) —
SCHEMBL10550552 0.79 NPC1 (0.41) KMT2AMEN1SMN1; SMN2ALDH1A1L3MBTL1
SCHEMBL10548985 0.79 LMNA (0.38) KMT2AMEN1LMNASMN1; SMN2TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4831130-A β-lactam antibacterial agents HOFFMANN-LA ROCHE INC. (US) 1989-05-16 — — US disclosed
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