SCHEMBL8260575

SCHEMBL8260575

COOCc1ccc(C)c(-c2cnc(NC(=O)c3ccncc3C)cn2)c1

nearest known ligand 0.48

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ IL2 P60568 11/20 0.48
▸ ABL1 P00519 2/20 0.38
▸ WNT3A P56704 1/20 0.36
▸ MAP4K1 Q92918 1/20 0.35
▸ POLQ O75417 2/20 0.35
▸ LRRK2 Q5S007 1/20 0.34

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
SCHEMBL8260168 0.92 IL2 (0.58) IL2ABL1LRRK2
SCHEMBL15395851 0.87 IL2 (0.51) IL2ABL1
SCHEMBL8259868 0.83 IL2 (0.40) IL2POLQ
SCHEMBL15395772 0.82 IL2 (0.55) IL2ABL1
SCHEMBL5554369 0.82 IL2 (0.51) IL2ABL1
SCHEMBL13170837 0.81 ABCB1 (0.43) WNT3A
SCHEMBL5550529 0.80 IL2 (0.49) IL2
SCHEMBL5556181 0.79 IL2 (0.47) IL2ABL1
SCHEMBL5555293 0.79 IL2 (0.51) IL2ABL1
SCHEMBL8259823 0.79 IL2 (0.46) IL2ABL1POLQ

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
WO-2006081391-A2 COMPOUNDS FOR INFLAMMATION AND IMMUNE-RELATED USES SYNTA PHARMACEUTICALS CORP. (US) 2006-08-03 — — WO disclosed
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