SCHEMBL8260033

SCHEMBL8260033

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

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ POLB P06746 2/20 0.35
▸ IL2 P60568 7/20 0.35
▸ MAPT P10636 1/20 0.35
▸ USP2 O75604 1/20 0.34
▸ KDM4E B2RXH2 1/20 0.34
▸ MAPK1 P28482 1/20 0.34
▸ MAOA P21397 3/20 0.34
▸ MAOB P27338 3/20 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
SCHEMBL8257487 0.92 POLB (0.40) LMNAALDH1A1POLBMAPTUSP2
SCHEMBL8260160 0.88 LMNA (0.38) LMNAALDH1A1POLBIL2MAPT
SCHEMBL8259732 0.85 LMNA (0.37) LMNAALDH1A1POLBIL2USP2
SCHEMBL8252236 0.83 ALDH1A1 (0.39) LMNAALDH1A1POLBIL2MAPT
SCHEMBL8262622 0.83 IL2 (0.43) LMNAALDH1A1POLBIL2MAPT
SCHEMBL8251749 0.81 IL2 (0.53) IL2
SCHEMBL8260165 0.81 IL2 (0.45) ALDH1A1IL2
SCHEMBL8256827 0.81 LMNA (0.38) LMNAALDH1A1POLBIL2USP2
SCHEMBL8260246 0.80 LMNA (0.39) LMNAALDH1A1POLBIL2USP2
SCHEMBL8259763 0.80 POLB (0.41) LMNAALDH1A1POLBIL2MAPT

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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