SCHEMBL5200380

SCHEMBL5200380

CCCCCCC[CH]S(N)(=O)=O

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 1/20 0.50
TSHR P16473 2/20 0.48
CA2 P00918 10/20 0.47
CA1 P00915 8/20 0.45
CA9 Q16790 7/20 0.45
CA12 O43570 3/20 0.45
CA7 P43166 3/20 0.45
CA14 Q9ULX7 3/20 0.45
CA3 P07451 2/20 0.45
CA4 P22748 2/20 0.45
CA6 P23280 2/20 0.45
CA5A P35218 2/20 0.45
CA5B Q9Y2D0 2/20 0.45
FAAH O00519 2/20 0.43
TRPV1 Q8NER1 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
SCHEMBL483132 0.79
SCHEMBL7860226 0.78 TSHR (0.50) PPARATSHRFAAHTRPV1
SCHEMBL5074183 0.78 TSHR (0.50) PPARATSHRFAAHTRPV1
SCHEMBL322670 0.78 TSHR (0.50) PPARATSHRFAAHTRPV1
SCHEMBL21616869 0.78 TSHR (0.50) PPARATSHRFAAHTRPV1
SCHEMBL700497 0.76 TSHR (0.48) PPARATSHRCA2CA1FAAH
SCHEMBL699652 0.76 TSHR (0.48) PPARATSHRCA2CA1FAAH
SCHEMBL8954181 0.76 TSHR (0.48) PPARATSHRCA2CA1FAAH
SCHEMBL9012336 0.76 TSHR (0.48) PPARATSHRCA2CA1FAAH
SCHEMBL27588305 0.76 TSHR (0.48) PPARATSHRCA2CA1FAAH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1728838-B1 Ink composition for ink jet-recording and method for preparing lithographic printing plate using the same FUJIFILM CORP (JP) 2007-08-15 EP disclosed
EP-1728838-A1 Ink composition for ink jet-recording and method for preparing lithographic printing plate using the same Fuji Photo Film Co., Ltd. (JP) 2006-12-06 EP disclosed