SCHEMBL10402003

SCHEMBL10402003

Cc1ccc(S([NH])(=O)=O)s1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.50
DAO P14920 1/20 0.41
POLB P06746 2/20 0.39
L3MBTL1 Q9Y468 2/20 0.38
ALDH1A1 P00352 4/20 0.37
NPSR1 Q6W5P4 3/20 0.36
LMNA P02545 2/20 0.36
HPGD P15428 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
MEN1 O00255 1/20 0.36
S1PR4 O95977 1/20 0.36
TP53 P04637 1/20 0.36
PKM P14618 1/20 0.36
ALOX15 P16050 1/20 0.36
S1PR1 P21453 1/20 0.36
HTT P42858 1/20 0.36
PPARG P37231 1/20 0.34
NCOA2 Q15596 1/20 0.34
NCOA1 Q15788 1/20 0.34
NCOA3 Q9Y6Q9 1/20 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
SCHEMBL2606680 0.78 KMT2A (0.52) KMT2ADAOPOLBL3MBTL1ALDH1A1
SCHEMBL2120202 0.76 KMT2A (0.50) KMT2ADAOPOLBL3MBTL1ALDH1A1
SCHEMBL5421377 0.76 KMT2A (0.50) KMT2ADAOPOLBL3MBTL1ALDH1A1
SCHEMBL2012357 0.76 KMT2A (0.50) KMT2APOLBCA12CA1CA2
SCHEMBL31560169 0.76 KMT2A (0.50) KMT2ADAOPOLBL3MBTL1ALDH1A1
SCHEMBL16732 0.76 KMT2A (0.50) KMT2ADAOPOLBL3MBTL1ALDH1A1
SCHEMBL10534763 0.74 KMT2A (0.48) KMT2ADAOPOLBL3MBTL1ALDH1A1
SCHEMBL10534768 0.74 KMT2A (0.48) KMT2ADAOPOLBL3MBTL1ALDH1A1
Methane SCHEMBL4761017 0.74 KMT2A (0.48) KMT2APOLBCA12CA1CA2
SCHEMBL10535198 0.74 KMT2A (0.48) KMT2ADAOPOLBL3MBTL1ALDH1A1

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
US-4914206-A ANTIBIOTICS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1990-04-03 US disclosed
EP-0226896-A2 Lankacidin derivatives and production thereof Takeda Chemical Industries, Ltd. (JP) 1987-07-01 EP disclosed