SCHEMBL28175124

SCHEMBL28175124

Cc1nccn1S(N)(=O)=O

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.45
RECQL P46063 1/20 0.44
CA12 O43570 1/20 0.44
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
CA9 Q16790 1/20 0.44
SMN1; SMN2 Q16637 3/20 0.43
HTT P42858 1/20 0.42
KMT2A Q03164 3/20 0.41
KDM4E B2RXH2 1/20 0.41
TSHR P16473 1/20 0.41
HSD17B10 Q99714 1/20 0.41
ALDH1A1 P00352 3/20 0.40
RAB9A P51151 1/20 0.40

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
SCHEMBL8148844 0.82 RECQL (0.46) POLBRECQLCA12CA1CA2
SCHEMBL15041407 0.80 RECQL (0.45) POLBRECQLCA12CA1CA2
SCHEMBL28827551 0.78 RECQL (0.44) POLBRECQLCA12CA1CA2
SCHEMBL21034083 0.78 RECQL (0.44) POLBRECQLCA12CA1CA2
SCHEMBL27203361 0.78 RECQL (0.44) POLBRECQLCA12CA1CA2
SCHEMBL2053373 0.75 KDM4E (0.45) POLBRECQLCA12CA1CA2
SCHEMBL288348 0.75 CA2 (0.39) RECQLCA12CA1CA2CA9
SCHEMBL23701634 0.74 KMT2A (0.41) POLBRECQLCA12CA1CA2
Sulfuric Acid SCHEMBL22462539 0.74 RECQL (0.41) POLBRECQLCA12CA1CA2
SCHEMBL28801470 0.74 CA12 (0.31) POLBCA12CA1CA2CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107108633-A The Imidazopyridazine derivative connected as the heterocyclic radical of PI3K beta inhibitors 詹森药业有限公司 2017-08-29 CN disclosed