SCHEMBL7582804

SCHEMBL7582804

C[N]Cc1ccc(S(=O)(=O)O)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.46
▸ TSHR P16473 2/20 0.45
▸ ALDH1A1 P00352 2/20 0.45
▸ NT5E P21589 1/20 0.45
▸ SMN1; SMN2 Q16637 2/20 0.43
▸ POLB P06746 1/20 0.42
▸ CYP2D6 P10635 1/20 0.42
▸ TDP1 Q9NUW8 1/20 0.41
▸ MIF P14174 1/20 0.38
▸ CYP1A2 P05177 1/20 0.37
▸ CYP2C9 P11712 1/20 0.37
▸ RPS6KA3 P51812 1/20 0.37
▸ CA2 P00918 5/20 0.36
▸ CA1 P00915 3/20 0.36
▸ CA12 O43570 2/20 0.36
▸ CA4 P22748 2/20 0.36
▸ CA6 P23280 2/20 0.36
▸ CA5A P35218 2/20 0.36
▸ CA7 P43166 2/20 0.36
▸ CA9 Q16790 2/20 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
SCHEMBL8000086 0.80 LMNA (0.43) LMNATSHRALDH1A1NT5ESMN1; SMN2
SCHEMBL20080951 0.79 LMNA (0.46) LMNATSHRALDH1A1NT5ESMN1; SMN2
SCHEMBL93796 0.76 CA2 (0.61) LMNATSHRALDH1A1NT5ESMN1; SMN2
SCHEMBL3386871 0.76 LMNA (0.52) LMNATSHRALDH1A1NT5ESMN1; SMN2
SCHEMBL1563242 0.76 CA2 (0.61) LMNATSHRALDH1A1NT5ESMN1; SMN2
SCHEMBL9619529 0.75 LMNA (0.56) LMNATSHRALDH1A1NT5ESMN1; SMN2
SCHEMBL11583429 0.75 LMNA (0.56) LMNATSHRALDH1A1NT5ESMN1; SMN2
SCHEMBL10706478 0.75 TSHR (0.67) LMNATSHRALDH1A1NT5EPOLB
SCHEMBL19075272 0.75 LMNA (0.42) LMNATSHRALDH1A1NT5ESMN1; SMN2
SCHEMBL14830748 0.74 LMNA (0.50) LMNATSHRALDH1A1NT5ESMN1; SMN2

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-0957135-B1 Water-soluble halotriazine-containing azo compounds, preparation thereof and use thereof as dyes DYSTAR TEXTILFARBEN GMBH & CO (DE) 2002-09-25 — — EP disclosed
EP-0957135-A1 Water-soluble halotriazine-containing azo compounds, preparation thereof and use thereof as dyes DyStar Textilfarben GmbH & Co. Deutschland KG (DE) 1999-11-17 — — EP disclosed
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