SCHEMBL21251024

SCHEMBL21251024

Cc1ccc([S+]([O-])n2c(I)cc3c(Cl)ccnc32)cc1

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ CDC7 O00311 1/20 0.31
▸ PIM1 P11309 1/20 0.31
▸ CDK9 P50750 1/20 0.31

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
SCHEMBL18380996 0.87 ENPP3 (0.32) —
SCHEMBL25802928 0.87 ENPP3 (0.32) —
SCHEMBL21251023 0.82 KDM4E (0.32) —
SCHEMBL1749021 0.72 PTGDR2 (0.44) POLBKMT2A
SCHEMBL17918597 0.71 POLB (0.33) POLBKMT2ACDC7PIM1CDK9
SCHEMBL2043856 0.70 PIM1 (0.46) KMT2ACDC7PIM1CDK9
SCHEMBL21490844 0.64 PTGDR2 (0.46) POLBKMT2A
SCHEMBL31240613 0.63 CDC7 (0.33) CDC7PIM1CDK9
SCHEMBL2039524 0.63 CDC7 (0.33) CDC7PIM1CDK9
SCHEMBL12133625 0.62 CDC7 (0.47) POLBKMT2ACDC7PIM1CDK9

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
EP-3042903-B1 Substituted hetero-bicyclic compounds, compositions and medicinal applications thereof IMPETIS BIOSCIENCES LTD (IN) 2019-08-14 — — EP disclosed
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