SCHEMBL6467529

SCHEMBL6467529

C=CCc1ccc(S(=O)(=O)N(C(N)=O)c2ccc(Cc3ccc(N(C(N)=O)S(=O)(=O)c4ccc(CC=C)cc4)cc3)cc2)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 2/20 0.42
CYP2C8 P10632 3/20 0.37
CYP2C19 P33261 3/20 0.37
CYP2C18 P33260 2/20 0.37
KMT2A Q03164 2/20 0.37
CYP2C9 P11712 1/20 0.36
LMNA P02545 4/20 0.35
KDM4E B2RXH2 2/20 0.35
CNR1 P21554 1/20 0.35
ESR1 P03372 1/20 0.35
MAPT P10636 4/20 0.34
HSP90AA1 P07900 1/20 0.34
RECQL P46063 1/20 0.34
TP53 P04637 4/20 0.34
CA12 O43570 1/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
CA9 Q16790 1/20 0.34
CA14 Q9ULX7 1/20 0.34
MEN1 O00255 1/20 0.33

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
SCHEMBL6470650 0.84 CA12 (0.50) CYP2C19KMT2ACYP2C9LMNAKDM4E
SCHEMBL6467690 0.83 KMT2A (0.51) CNR2KMT2AESR1CA12CA1
SCHEMBL27679 0.82 LMNA (0.54) CNR2CYP2C19KMT2ACYP2C9LMNA
SCHEMBL6244071 0.81 KMT2A (0.57) CNR2KMT2AMAPTHSP90AA1CA12
SCHEMBL6466821 0.80 KMT2A (0.53) KMT2ALMNAKDM4EMAPTHSP90AA1
SCHEMBL6529186 0.80 CA1 (0.51) CNR2KMT2ACA12CA1CA2
SCHEMBL8620628 0.78 TP53 (0.55) CYP2C19KMT2ACYP2C9LMNAMAPT
SCHEMBL8837771 0.78 CA2 (0.52) KMT2ACA12CA1CA2CA9
SCHEMBL8837714 0.78 CA12 (0.41) KMT2ACYP2C9LMNAKDM4EMAPT
SCHEMBL6467475 0.77 KMT2A (0.46) KMT2ACA12CA1CA2CA9

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
EP-1480836-A1 MIXTURE OF COLOUR DEVELOPERS Ciba SC Holding AG (CH) 2004-12-01 EP disclosed
WO-2003074284-A1 MIXTURE OF COLOUR DEVELOPERS CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2003-09-12 WO disclosed
WO-2003074285-A1 HEAT SENSITIVE RECORDING MATERIAL CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2003-09-12 WO 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