SCHEMBL1710312

SCHEMBL1710312

COc1nc(N)nc(SC)n1

nearest known ligand 0.56

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HSP90AB1 P08238 2/20 0.56
HSP90AA1 P07900 7/20 0.44
ADORA2A P29274 2/20 0.39
ADORA1 P30542 2/20 0.39
TP53 P04637 1/20 0.38
POLB P06746 1/20 0.38
GAA P10253 1/20 0.38
TSHR P16473 1/20 0.38
HTT P42858 1/20 0.38
HSD17B10 Q99714 1/20 0.38
ABCB1 P08183 1/20 0.32
CCNA2 P20248 1/20 0.31
CDK2 P24941 1/20 0.31
CCNA1 P78396 1/20 0.31
ALDH1A1 P00352 1/20 0.30
MAPT P10636 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
PIK3CA P42336 1/20 0.30

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
SCHEMBL13741482 0.83 HSP90AB1 (0.37) HSP90AB1GAATSHRHTTALDH1A1
SCHEMBL3631158 0.80 HSP90AB1 (0.71) HSP90AB1HSP90AA1ADORA2AADORA1POLB
SCHEMBL8071682 0.80 HSP90AB1 (0.71) HSP90AB1HSP90AA1ADORA2AADORA1POLB
SCHEMBL138352 0.80 HSD17B10 (0.44) TP53POLBGAATSHRHTT
SCHEMBL1576395 0.80 TSHR (0.44) TP53POLBGAATSHRHTT
SCHEMBL10918490 0.77 HSP90AA1 (0.60) HSP90AB1HSP90AA1ADORA2AADORA1TP53
SCHEMBL10920686 0.77 HSP90AB1 (0.50) HSP90AB1HSP90AA1ADORA2AADORA1ALDH1A1
SCHEMBL9199934 0.75 HSP90AB1 (0.48) HSP90AB1HSP90AA1ADORA2AADORA1
SCHEMBL10648657 0.75 TP53 (0.34) HSP90AB1TP53POLBGAATSHR
SCHEMBL32665731 0.73 CYP1A2 (0.42) HSP90AB1TSHRALDH1A1MAPTSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118834325-A Acrylic ester polymer emulsion, preparation method and application 北京慕湖外加剂有限公司 2024-10-25 CN claimed
CN-118834325-A Acrylic ester polymer emulsion, preparation method and application 北京慕湖外加剂有限公司 2024-10-25 CN disclosed
CN-118834325-A Acrylic ester polymer emulsion, preparation method and application 北京慕湖外加剂有限公司 2024-10-25 CN disclosed
US-20110206834-A1 CURABLE COMPOSITION FOR TRANSFER MATERIALS, AND PATTERN FORMING PROCESS SHOWA DENKO K.K. (JP) 2011-08-25 US disclosed
EP-2345676-A1 CURABLE COMPOSITION FOR TRANSFER MATERIAL AND PATTERN FORMATION METHOD SHOWA DENKO K.K. (JP) 2011-07-20 EP disclosed
EP-0174574-A2 Fungicidal agents on the basis of triazine derivatives BAYER AG (DE) 1986-03-19 EP disclosed