SCHEMBL6464227

SCHEMBL6464227

O=C(Nc1ccc(Cc2ccc(NC(=O)NS(=O)(=O)c3ccc(C4CCCCC4)cc3)cc2)cc1)NS(=O)(=O)c1ccc(C2CCCCC2)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RORC P51449 1/20 0.57
ALDH1A1 P00352 4/20 0.53
LMNA P02545 3/20 0.53
MAPT P10636 2/20 0.53
SMN1; SMN2 Q16637 2/20 0.53
TP53 P04637 2/20 0.50
ATM Q13315 1/20 0.50
MITF O75030 1/20 0.48
KLF5 Q13887 1/20 0.48
POLB P06746 2/20 0.46
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
NAMPT P43490 3/20 0.46
CYP3A4 P08684 1/20 0.46
CYP2D6 P10635 1/20 0.46
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 1/20 0.46
F2 P00734 1/20 0.45
HDAC3 O15379 1/20 0.45
HDAC11 Q96DB2 1/20 0.45

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
SCHEMBL6467693 0.79 LMNA (0.64) ALDH1A1LMNAMAPTTP53NAMPT
SCHEMBL8418171 0.78 ALDH1A1 (0.57) ALDH1A1LMNAMAPTTP53POLB
SCHEMBL27680 0.78 CA12 (0.72) ALDH1A1LMNAMAPTTP53MEN1
SCHEMBL8417032 0.78 EGFR (0.57) ALDH1A1LMNAMAPTSMN1; SMN2TP53
SCHEMBL7774821 0.77 LMNA (0.61) ALDH1A1LMNAMAPTTP53CYP2C9
SCHEMBL11356835 0.77 HDAC8 (0.64) ALDH1A1SMN1; SMN2MITFKLF5MEN1
SCHEMBL6465976 0.77 MEN1 (0.49) ALDH1A1LMNASMN1; SMN2MEN1KMT2A
SCHEMBL8664046 0.76 LMNA (0.58) ALDH1A1LMNAMAPTSMN1; SMN2TP53
SCHEMBL6469820 0.76 LMNA (0.59) RORCLMNATP53NAMPTCYP2C9
SCHEMBL19085143 0.75 POLB (0.59) RORCALDH1A1MITFKLF5POLB

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 10 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-2003074285-A1 HEAT SENSITIVE RECORDING MATERIAL CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2003-09-12 WO disclosed
WO-2003074284-A1 MIXTURE OF COLOUR DEVELOPERS CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2003-09-12 WO disclosed
EP-0792755-B1 Thermosensitive recording material OJI PAPER CO (JP) 1998-11-11 EP disclosed
EP-0792755-A1 Thermosensitive recording material OJI PAPER COMPANY LIMITED (JP) 1997-09-03 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