SCHEMBL8712041

SCHEMBL8712041

Nc1cccc(C(=S)S)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ F2 P00734 1/20 0.52
▸ PLG P00747 1/20 0.52
▸ PRSS1 P07477 1/20 0.52
▸ PRSS2 P07478 1/20 0.52
▸ PRSS3 P35030 1/20 0.52
▸ PBRM1 Q86U86 1/20 0.50
▸ CYP3A4 P08684 1/20 0.48
▸ CASP1 P29466 1/20 0.48
▸ RECQL P46063 1/20 0.48
▸ ALDH1A1 P00352 6/20 0.44
▸ CA1 P00915 2/20 0.44
▸ CA2 P00918 2/20 0.44
▸ CA9 Q16790 2/20 0.44
▸ TDP1 Q9NUW8 2/20 0.44
▸ CA12 O43570 1/20 0.44
▸ CA7 P43166 1/20 0.44
▸ CA14 Q9ULX7 1/20 0.44
▸ SMN1; SMN2 Q16637 2/20 0.43
▸ HSD17B10 Q99714 2/20 0.43
▸ NPSR1 Q6W5P4 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
SCHEMBL1091579 0.79 F2 (0.59) F2PLGPRSS1PRSS2PRSS3
SCHEMBL11234413 0.79 PBRM1 (0.57) F2PLGPRSS1PRSS2PRSS3
SCHEMBL31650871 0.79 F2 (0.59) F2PLGPRSS1PRSS2PRSS3
SCHEMBL11234406 0.77 PBRM1 (0.61) F2PLGPRSS1PRSS2PRSS3
SCHEMBL11352289 0.76 PBRM1 (0.59) F2PLGPRSS1PRSS2PRSS3
SCHEMBL8718296 0.74 PARP1 (0.54) ALDH1A1POLBKDM4ETSHR
SCHEMBL8712276 0.74 CA12 (0.52) CYP3A4ALDH1A1CA1CA2CA9
SCHEMBL8712837 0.73 C1S (0.52) ALDH1A1TDP1SMN1; SMN2LMNAMEN1
SCHEMBL18560037 0.73 PBRM1 (0.61) F2PLGPRSS1PRSS2PRSS3
SCHEMBL8712629 0.73 FURIN (0.36) ALDH1A1TDP1SMN1; SMN2NPC1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5847061-A Process for producing polymers having terminal functional group which may be protected KURARAY CO., LTD. (JP) 1998-12-08 — — US disclosed
EP-0704460-B1 PROCESS FOR PRODUCING POLYMER TERMINATED WITH OPTIONALLY PROTECTED FUNCTIONAL GROUP KURARAY CO (JP) 1998-11-04 — — EP disclosed
EP-0704460-A1 PROCESS FOR PRODUCING POLYMER TERMINATED WITH OPTIONALLY PROTECTED FUNCTIONAL GROUP KURARAY CO., LTD. (JP) 1996-04-03 — — EP disclosed
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