SCHEMBL5406321

SCHEMBL5406321

CCCCCCCCCC(=O)c1cccc(-n2nnnc2S)c1

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ TP53 P04637 1/20 0.46
▸ HSD17B3 P37058 6/20 0.41
▸ MEN1 O00255 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ HTT P42858 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ ATM Q13315 1/20 0.40
▸ THRA P10827 1/20 0.39
▸ THRB P10828 1/20 0.39
▸ SOAT2 O75908 4/20 0.39
▸ SOAT1 P35610 4/20 0.39

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
SCHEMBL8943738 0.83 SMN1; SMN2 (0.52) TP53MAPT
SCHEMBL14498647 0.83 SMN1; SMN2 (0.52) TP53MAPT
SCHEMBL9869255 0.83 LMNA (0.48) TP53MEN1ALDH1A1MAPTKMT2A
SCHEMBL14498644 0.83 SMN1; SMN2 (0.52) TP53MAPT
SCHEMBL9769968 0.81 LMNA (0.48) ALDH1A1MAPTSOAT2SOAT1
SCHEMBL6571817 0.81 LMNA (0.48) ALDH1A1MAPTSOAT2SOAT1
SCHEMBL14498627 0.81 LMNA (0.48) ALDH1A1MAPTSOAT2SOAT1
SCHEMBL10349031 0.81 LMNA (0.48) ALDH1A1MAPTSOAT2SOAT1
SCHEMBL8059281 0.81 LMNA (0.48) ALDH1A1MAPTSOAT2SOAT1
SCHEMBL9769991 0.80 SOAT1 (0.45) TP53MEN1ALDH1A1MAPTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7172852-B2 Thermographic recording material with improved developability AGFA GEVAERT (BE) 2007-02-06 — — US disclosed
US-7153647-B2 Thermographic recording material with improved developability AGFA GEVAERT (BE) 2006-12-26 — — US disclosed
US-20050287482-A1 Thermographic recording material with improved developability AGFA-GEVAERT (BE) 2005-12-29 — — US disclosed
US-6962773-B2 Thermographic recording material with improved developability AGFA GEVAERT (BE) 2005-11-08 — — US disclosed
EP-1316845-B1 Thermographic recording material with improved developability AGFA GEVAERT (BE) 2005-04-20 — — EP disclosed
US-20040209189-A1 Thermographic recording material with improved developability AGFA-GEVAERT (BE) 2004-10-21 — — US disclosed
US-20030139292-A1 Thermographic recording material with improved developability AGFA-GEVAERT (BE) 2003-07-24 — — US disclosed
EP-1316845-A1 Thermographic recording material with improved developability Agfa-Gevaert (BE) 2003-06-04 — — EP disclosed
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