SCHEMBL19366587

SCHEMBL19366587

[O-][S+](c1ccccc1)n1cc(I)c2c(Cl)ncnc21

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ SRC P12931 1/20 0.40
▸ ADK P55263 7/20 0.38
▸ MEN1 O00255 1/20 0.36
▸ NR2F2 P24468 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ SLC29A1 Q99808 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.32
▸ GAA P10253 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ OPRD1 P41143 1/20 0.32
▸ OPRK1 P41145 1/20 0.32
▸ HTT P42858 1/20 0.32
▸ PAX8 Q06710 1/20 0.32
▸ TLR9 Q9NR96 1/20 0.32
▸ CHEK1 O14757 1/20 0.32

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
SCHEMBL19366442 0.84 ADK (0.33) ADK
SCHEMBL13616238 0.81 ALDH1A1 (0.38) SRCADKALDH1A1MAPT
SCHEMBL18967243 0.74 ADK (0.39) SRCADKMEN1NR2F2KMT2A
SCHEMBL21170650 0.73 PDE4A (0.38) SRCMEN1NR2F2KMT2AALDH1A1
SCHEMBL25065735 0.73 SRC (0.67) SRCADKMEN1NR2F2KMT2A
SCHEMBL398024 0.73 SRC (0.67) SRCADKMEN1NR2F2KMT2A
SCHEMBL18902127 0.72 JAK2 (0.35) ALDH1A1HTT
SCHEMBL24490651 0.71 RET (0.52) SRC
SCHEMBL18380981 0.70 PDE4A (0.35) SRCMEN1NR2F2KMT2AALDH1A1
SCHEMBL3232814 0.69 SRC (0.42) SRCADKMEN1NR2F2KMT2A

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-2560972-B1 COMPOUNDS AND METHODS FOR KINASE MODULATION, AND INDICATIONS THEREFOR PLEXXIKON INC (US) 2017-09-20 — — EP disclosed
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