SCHEMBL27705388

SCHEMBL27705388

COc1c(C(=O)O)ccc(Cl)c1-c1cnc(NC(=O)c2ccncc2C)cn1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SORT1 Q99523 4/20 0.38
▸ TYK2 P29597 3/20 0.38
▸ JAK2 O60674 1/20 0.38
▸ IL2 P60568 2/20 0.37
▸ RAB9A P51151 3/20 0.37
▸ PDE4D Q08499 2/20 0.37
▸ MEN1 O00255 2/20 0.37
▸ KMT2A Q03164 2/20 0.37
▸ NPC1 O15118 2/20 0.36
▸ ALOX15 P16050 1/20 0.36
▸ HTT P42858 1/20 0.36
▸ PDE4A P27815 1/20 0.36
▸ PDE4B Q07343 1/20 0.36
▸ PDE4C Q08493 1/20 0.36
▸ ICOSLG O75144 2/20 0.35
▸ ICOS Q9Y6W8 2/20 0.35
▸ IKBKB O14920 1/20 0.35
▸ CHUK O15111 1/20 0.35
▸ CLK1 P49759 1/20 0.35
▸ CLK2 P49760 1/20 0.35

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
SCHEMBL27705333 0.91 IL2 (0.40) SORT1IL2RAB9ANPC1ALOX15
SCHEMBL5550895 0.76 IL2 (0.43) IL2RAB9AMEN1KMT2ANPC1
SCHEMBL15395770 0.76 IL2 (0.46) SORT1IL2RAB9ANPC1ALOX15
SCHEMBL5554305 0.75 IL2 (0.44) IL2RAB9AMEN1KMT2ANPC1
SCHEMBL5998369 0.74 IL2 (0.45) IL2RAB9AKMT2ANPC1ALOX15
SCHEMBL15395989 0.73 IL2 (0.43) IL2RAB9AKMT2ANPC1ALOX15
SCHEMBL15395956 0.72 KDM4E (0.47) IL2RAB9AMEN1KMT2ANPC1
SCHEMBL5554346 0.72 IL2 (0.52) SORT1TYK2JAK2IL2KMT2A
SCHEMBL5554247 0.72 ALDH1A1 (0.48) TYK2JAK2IL2RAB9AMEN1
SCHEMBL5556038 0.72 ALDH1A1 (0.41) IL2RAB9AMEN1KMT2ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101163478-A Compounds for inflammation and immune-related uses SYNTA PHARMACEUTICALS CORP (US) 2008-04-16 — — CN claimed
CN-101163478-A Compounds for inflammation and immune-related uses SYNTA PHARMACEUTICALS CORP (US) 2008-04-16 — — CN disclosed
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