SCHEMBL9327344

SCHEMBL9327344

CCNc1cc(S(=O)(=O)O)ccc1S(=O)(=O)O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.44
HSD17B10 Q99714 3/20 0.41
HPGD P15428 1/20 0.41
HIF1A Q16665 1/20 0.41
HTR6 P50406 1/20 0.41
CASP6 P55212 2/20 0.40
TIMP3 P35625 1/20 0.38
CA1 P00915 3/20 0.38
CA2 P00918 3/20 0.38
CA12 O43570 2/20 0.38
CA7 P43166 2/20 0.38
CA14 Q9ULX7 2/20 0.38
SNCA P37840 1/20 0.37
ALDH1A1 P00352 6/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
CYP3A4 P08684 1/20 0.36
TSHR P16473 1/20 0.36
RECQL P46063 1/20 0.36
CASR P41180 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
SCHEMBL9329057 0.86 TIMP3 (0.48) LMNAHSD17B10HPGDHIF1ACASP6
SCHEMBL6660827 0.83 HPGD (0.41) LMNAHSD17B10HPGDHIF1AHTR6
SCHEMBL6660835 0.83 CYP3A4 (0.56) LMNACASP6CA1CA2CA12
SCHEMBL9329308 0.81 RAPGEF4 (0.47) LMNAHSD17B10HPGDHIF1AHTR6
SCHEMBL3827942 0.81 TIMP3 (0.38) LMNAHSD17B10HPGDHIF1ACASP6
SCHEMBL8981201 0.80 CASP6 (0.43) LMNAHSD17B10HPGDHTR6CASP6
SCHEMBL3827944 0.80 ALDH1A1 (0.42) LMNAHSD17B10HPGDHIF1ACASP6
SCHEMBL9330352 0.80 MAPT (0.49) LMNAALDH1A1GAAMAPT
SCHEMBL8619918 0.79 CYP3A4 (0.43) LMNAHSD17B10HPGDCASP6CA1
SCHEMBL12421835 0.77 LMNA (0.45) LMNACA1CA2CA12CA14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0464448-B1 Reactive azo dyes having at least two halogenotriazine anchors BASF AG (DE) 1994-08-31 EP disclosed
EP-0465939-B1 Double reactive dyestuffs with four halogenetriazinyl anchors BASF AG (DE) 1994-03-16 EP disclosed
US-5223607-A REACTIVE AZO DYES WITH AT LEST TWO REACTIVE HALOTRIAZINE GROUPS BASF AKTIENGESELLSCHAFT (DE) 1993-06-29 US disclosed
US-5216137-A Colorfast red or violet shades on cotton BASF AKTIENGESELLSCHAFT (DE) 1993-06-01 US disclosed
EP-0465939-A1 Double reactive dyestuffs with four halogenetriazinyl anchors BASF Aktiengesellschaft (DE) 1992-01-15 EP disclosed
EP-0464448-A1 Reactive azo dyes having at least two halogenotriazine anchors BASF Aktiengesellschaft (DE) 1992-01-08 EP disclosed