SCHEMBL22861889

SCHEMBL22861889

C=CS(=O)(=O)c1ccc(N=Nc2c(S(=O)(=O)O)cc3cc(S(=O)(=O)O)c(N=Nc4cc(C)c(S(=O)(=O)C=C)cc4OC)c(O)c3c2N)c(S(=O)(=O)O)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ENPP2 Q13822 8/20 0.52
▸ PRMT1 Q99873 2/20 0.51
▸ MEN1 O00255 2/20 0.46
▸ KMT2A Q03164 2/20 0.46
▸ HTT P42858 1/20 0.46
▸ PTPN1 P18031 3/20 0.43
▸ USP2 O75604 1/20 0.41
▸ ATM Q13315 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ PHLPP2 Q6ZVD8 2/20 0.41
▸ THRB P10828 2/20 0.41
▸ CYP1A2 P05177 1/20 0.40
▸ KDM4E B2RXH2 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ TP53 P04637 1/20 0.40
▸ CYP3A4 P08684 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ HPGD P15428 1/20 0.40
▸ ALOX15 P16050 1/20 0.40
▸ APEX1 P27695 1/20 0.40

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
SCHEMBL15671909 0.91 PRMT1 (0.61) ENPP2PRMT1MEN1KMT2AHTT
SCHEMBL15671910 0.85 ENPP2 (0.54) ENPP2PRMT1MEN1KMT2AHTT
SCHEMBL15684671 0.84 ENPP2 (0.51) ENPP2PRMT1MEN1KMT2AHTT
SCHEMBL17109629 0.84 PRMT1 (0.45) ENPP2PRMT1MEN1KMT2AHTT
SCHEMBL14388841 0.83 THRB (0.51) ENPP2PRMT1MEN1KMT2AHTT
SCHEMBL17109631 0.81 MEN1 (0.49) ENPP2PRMT1MEN1KMT2AHTT
SCHEMBL18684955 0.80 ENPP2 (0.49) ENPP2PRMT1MEN1KMT2AHTT
SCHEMBL17109640 0.79 PRMT1 (0.62) ENPP2PRMT1MEN1KMT2AHTT
SCHEMBL18684930 0.77 THRB (0.53) ENPP2PRMT1MEN1KMT2AHTT
SCHEMBL18684929 0.77 THRB (0.53) ENPP2PRMT1MEN1KMT2AHTT

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-3752649-B1 PROCESS FOR THE SIMULTANEOUS TANNING AND DYEING OF COLLAGEN CONTAINING FIBROUS MATERIAL HUNTSMAN ADV MAT SWITZERLAND (CH) 2021-11-17 — — EP disclosed
US-20210002735-A1 Process for the Simultaneous Tanning and Dyeing of Collagen Containing Fibrous Material HUNTSMAN ADVANCED MATERIALS (SWITZERLAND) GMBH (CH) 2021-01-07 — — US disclosed
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