SCHEMBL6467531

SCHEMBL6467531

O=C(Nc1cccc2c(NC(=O)NS(=O)(=O)Cc3ccccc3)cccc12)NS(=O)(=O)Cc1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.52
GSK3B P49841 1/20 0.52
CA1 P00915 1/20 0.49
CA2 P00918 1/20 0.49
MMP1 P03956 1/20 0.49
MMP2 P08253 1/20 0.49
MMP9 P14780 1/20 0.49
MMP8 P22894 1/20 0.49
MMP13 P45452 1/20 0.49
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
MAPT P10636 1/20 0.45
TRPV1 Q8NER1 1/20 0.45
MET P08581 1/20 0.44
POLB P06746 1/20 0.44
CFD P00746 1/20 0.43
PARP14 Q460N5 1/20 0.43
NLRP3 Q96P20 1/20 0.43
ALDH1A1 P00352 2/20 0.43
P4HTM Q9NXG6 1/20 0.43

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
SCHEMBL8726377 0.91 CA1 (0.55) KDM4EGSK3BCA1CA2MMP1
SCHEMBL8621657 0.83 AKR1C4 (0.45) CA1CA2MMP1MMP2MMP9
SCHEMBL6464498 0.81 ACP1 (0.61) KDM4ECA1CA2MMP1MMP2
SCHEMBL6467730 0.80 ACP1 (0.51) CA1CA2MMP1MMP2MMP9
SCHEMBL29402394 0.78 IDH1 (0.45) CA1CA2MMP1MMP2MMP9
SCHEMBL6466723 0.78 CYP2C9 (0.57) CA1CA2MMP1MMP2MMP9
SCHEMBL6463105 0.76 CA1 (0.57) CA1CA2MMP1MMP2MMP9
SCHEMBL6465979 0.76 EPHX1 (0.62) KDM4EGSK3BMEN1KMT2AMAPT
SCHEMBL1514314 0.76 KDM4E (0.84) KDM4EGSK3BCA1CA2MEN1
SCHEMBL8091378 0.75 CNR1 (0.57) CA1CA2MMP1MMP2MMP9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050255998-A1 Mixture of colour developers CIBA SPECIALTY CHEMICALS CORP. 2005-11-17 US disclosed
US-20050106491-A1 Heat sensitive recording material CIBA SPECIALTY CHEMICALS CORP. 2005-05-19 US disclosed
EP-1480835-A1 HEAT SENSITIVE RECORDING MATERIAL Ciba SC Holding AG (CH) 2004-12-01 EP disclosed
WO-2003074285-A1 HEAT SENSITIVE RECORDING MATERIAL CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2003-09-12 WO disclosed
EP-0604832-B1 Thermosensitive recording material OJI PAPER CO (JP) 1998-06-03 EP disclosed
US-5612280-A AROMATIC SULFONYLUREA AND SULFONYLTHIOUREA DERIVATIVES AS COLOR DEVELOPERS; COLORFASTNESS, STORAGE STABILITY, WHITENESS NEW OJI PAPER CO., LTD. (JP) 1997-03-18 US disclosed
EP-0604832-A2 Thermosensitive recording material NEW OJI PAPER CO., LTD. (JP) 1994-07-06 EP disclosed