SCHEMBL8259763

SCHEMBL8259763

C=CO/C(=C\C)c1ccc(Cl)c(-c2cnc(NC(=O)c3snnc3C)cn2)c1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 2/20 0.41
▸ USP2 O75604 1/20 0.40
▸ HTT P42858 1/20 0.39
▸ STIM1 Q13586 1/20 0.37
▸ ORAI1 Q96D31 1/20 0.37
▸ ORAI2 Q96SN7 1/20 0.37
▸ LMNA P02545 3/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ KDM4E B2RXH2 1/20 0.36
▸ MAOA P21397 3/20 0.35
▸ MAOB P27338 3/20 0.35
▸ GAA P10253 1/20 0.34
▸ MAPK1 P28482 1/20 0.34
▸ MAPT P10636 2/20 0.33
▸ ATM Q13315 1/20 0.33
▸ IL2 P60568 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
SCHEMBL8260160 0.91 LMNA (0.38) POLBUSP2HTTLMNAALDH1A1
SCHEMBL8257487 0.88 POLB (0.40) POLBUSP2HTTSTIM1ORAI1
SCHEMBL8256962 0.88 POLB (0.41) POLBUSP2HTTSTIM1ORAI1
SCHEMBL8263057 0.83 POLB (0.42) POLBUSP2HTTLMNAALDH1A1
SCHEMBL15395955 0.82 POLB (0.50) POLBUSP2HTTSTIM1ORAI1
SCHEMBL8251756 0.80 IL2 (0.39) HTTSTIM1ORAI1ORAI2LMNA
SCHEMBL8256457 0.80 IL2 (0.44) STIM1ORAI1ORAI2MAOBIL2
SCHEMBL8260033 0.80 LMNA (0.36) POLBUSP2LMNAALDH1A1KDM4E
SCHEMBL8252236 0.79 ALDH1A1 (0.39) POLBUSP2HTTLMNAALDH1A1
SCHEMBL8260064 0.78 IL2 (0.46) STIM1ORAI1ORAI2MAOBIL2

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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