SCHEMBL31349

SCHEMBL31349

CC1(COc2ccc(S(=O)(=O)c3ccc(OCc4ccccc4)cc3)cc2)CO1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.52
CA1 P00915 1/20 0.52
CA2 P00918 1/20 0.52
CA4 P22748 1/20 0.52
CA5A P35218 1/20 0.52
CA7 P43166 1/20 0.52
CA9 Q16790 1/20 0.52
CA5B Q9Y2D0 1/20 0.52
AR P10275 9/20 0.49
CTRC Q99895 1/20 0.47
NPC1 O15118 1/20 0.46
HPGD P15428 1/20 0.46
RAB9A P51151 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
MAOB P27338 1/20 0.46
PIR O00625 1/20 0.46
RORC P51449 1/20 0.45
PTGES2 Q9H7Z7 1/20 0.44
MMP13 P45452 4/20 0.43
MMP1 P03956 3/20 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
SCHEMBL1144646 0.92 CA12 (0.45) CA12CA1CA2CA4CA5A
SCHEMBL6301749 0.90 MAOB (0.48) CA12CA1CA2CA7CA9
SCHEMBL1228633 0.89 PTGS1 (0.51) NPC1RAB9ASMN1; SMN2MAOBMMP13
SCHEMBL9405446 0.89 CA12 (0.51) CA12CA1CA2CA4CA5A
SCHEMBL8611881 0.89 PKM (0.49) NPC1HPGDRAB9ASMN1; SMN2MAOB
SCHEMBL5707066 0.88 CA12 (0.43) CA12CA1CA2CA4CA5A
SCHEMBL7720231 0.84 PKM (0.51) CA12CA1CA2CA9SMN1; SMN2
SCHEMBL9479164 0.82 SRD5A2 (0.62) NPC1RAB9ASMN1; SMN2MAOB
SCHEMBL6736842 0.82 GSTP1 (0.47) CA12CA1CA2CA4CA5A
SCHEMBL7108878 0.82 CA12 (0.74) CA12CA1CA2CA4CA5A

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 518 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150051070-A1 THERMAL RECORDING MATERIAL FINE ACE CORPORATION (JP) 2015-02-19 US claimed
EP-2829409-A1 THERMAL RECORDING MATERIAL Fine Ace Corporation (JP) 2015-01-28 EP claimed
EP-1092553-B1 THERMAL RECORDING MATERIAL JUJO PAPER CO LTD (JP) 2006-09-20 EP claimed
EP-1092552-B1 THERMAL RECORDING MATERIAL JUJO PAPER CO LTD (JP) 2004-09-29 EP claimed
EP-1140515-B1 HEAT SENSITIVE RECORDING MATERIAL CIBA SC HOLDING AG (CH) 2004-09-15 EP claimed
US-6677275-B1 Thermal recording material NIPPON PAPER INDUSTRIES CO., LTD. (JP) 2004-01-13 US claimed
US-6624117-B1 Heat sensitive recording material CIBA SPECIALTY CHEMICALS CORPORATION 2003-09-23 US claimed
EP-1160094-B1 Heat-sensitive recording material OJI PAPER CO (JP) 2003-09-03 EP claimed
US-20030139293-A1 Heat sensitive recording material CIBA SPECIALTY CHEMICALS CORP. 2003-07-24 US claimed
EP-1268215-A1 HEAT SENSITIVE RECORDING MATERIAL Ciba SC Holding AG (CH) 2003-01-02 EP claimed
EP-0526072-B1 Thermosensitive recording material NEW OJI PAPER CO LTD (JP) 1995-09-13 EP claimed
US-5446009-A Thermal color developing layer consists of an organic color developer, a higher fatty acid metal double salt and an electron doner; storage stability, oil/plasticizing/weather/ light resistance NIPPON PAPER INDUSTRIES CO., LTD. (JP) 1995-08-29 US claimed
EP-0542556-B1 Thermosensitive recording material NEW OJI PAPER CO LTD (JP) 1995-07-19 EP claimed
US-5405821-A Containing a 4-hydroxyphenylarylsulfone color developer NIPPON PAPER INDUSTRIES CO., LTD. (JP) 1995-04-11 US claimed
EP-0599580-A1 Thermal recording sheet NIPPON PAPER INDUSTRIES CO., LTD. (JP) 1994-06-01 EP claimed
US-5314859-A Thermosensitive recording material OJI PAPER CO., LTD. (JP) 1994-05-24 US claimed
EP-0585127-A2 Thermal Recording sheet NIPPON PAPER INDUSTRIES CO., LTD. (JP) 1994-03-02 EP claimed
US-5246906-A Sulfonyl-urea or -thiourea color developer, oil and plasticizer resistant, storage stable OJI PAPER CO., LTD. (JP) 1993-09-21 US claimed
EP-0542556-A1 Thermosensitive recording material NEW OJI PAPER CO., LTD. (JP) 1993-05-19 EP claimed
EP-0526072-A1 Thermosensitive recording material NEW OJI PAPER CO., LTD. (JP) 1993-02-03 EP claimed