SCHEMBL8252236

SCHEMBL8252236

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

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.39
▸ LMNA P02545 1/20 0.38
▸ POLB P06746 2/20 0.36
▸ IL2 P60568 8/20 0.36
▸ USP2 O75604 1/20 0.35
▸ KDM4E B2RXH2 1/20 0.35
▸ MAOA P21397 1/20 0.35
▸ MAOB P27338 1/20 0.35
▸ HTT P42858 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ NPC1 O15118 1/20 0.34
▸ PKM P14618 1/20 0.34
▸ RAB9A P51151 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
SCHEMBL8256962 0.91 POLB (0.41) ALDH1A1LMNAPOLBUSP2KDM4E
SCHEMBL8260160 0.88 LMNA (0.38) ALDH1A1LMNAPOLBIL2USP2
SCHEMBL8260246 0.87 LMNA (0.39) ALDH1A1LMNAPOLBIL2USP2
SCHEMBL8260033 0.83 LMNA (0.36) ALDH1A1LMNAPOLBIL2USP2
SCHEMBL8256827 0.82 LMNA (0.38) ALDH1A1LMNAPOLBIL2USP2
SCHEMBL8263037 0.82 IL2 (0.46) ALDH1A1LMNAPOLBIL2USP2
SCHEMBL8259732 0.82 LMNA (0.37) ALDH1A1LMNAPOLBIL2USP2
SCHEMBL8259823 0.80 IL2 (0.46) IL2
SCHEMBL8259763 0.79 POLB (0.41) ALDH1A1LMNAPOLBIL2USP2
SCHEMBL8256460 0.78 IL2 (0.56) IL2

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
Send feedback