SCHEMBL11542147

SCHEMBL11542147

CCNC(=O)Oc1c(-n2nc3ccccc3n2)cc(C(C)(C)CC)cc1C(C)(C)CC

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.36
NPC1 O15118 4/20 0.36
RAB9A P51151 4/20 0.36
SMN1; SMN2 Q16637 3/20 0.36
KDM4E B2RXH2 5/20 0.35
POLB P06746 2/20 0.35
PPARG P37231 4/20 0.35
PPARA Q07869 1/20 0.35
HPGD P15428 3/20 0.34
MAPT P10636 3/20 0.34
TDP1 Q9NUW8 2/20 0.34
NPSR1 Q6W5P4 2/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
MAPK1 P28482 1/20 0.33
GRM4 Q14833 1/20 0.33
MAPK13 O15264 1/20 0.32
MAPK12 P53778 1/20 0.32
MAPK11 Q15759 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
SCHEMBL11541586 0.90 ALDH1A1 (0.37) ALDH1A1
SCHEMBL11542187 0.88 MAPK13 (0.41) ALDH1A1NPC1RAB9ASMN1; SMN2KDM4E
SCHEMBL10950078 0.87 RAB9A (0.46) ALDH1A1NPC1RAB9ASMN1; SMN2KDM4E
SCHEMBL8995872 0.84 KMT2A (0.38) ALDH1A1NPC1RAB9ASMN1; SMN2KDM4E
SCHEMBL9870052 0.82 ALDH1A1 (0.35) ALDH1A1NPC1RAB9ASMN1; SMN2KDM4E
SCHEMBL14594273 0.81 KDM4E (0.39) ALDH1A1NPC1RAB9ASMN1; SMN2KDM4E
SCHEMBL39146 0.76 NPC1 (0.45) ALDH1A1NPC1RAB9ASMN1; SMN2KDM4E
SCHEMBL29350743 0.76 NPC1 (0.45) ALDH1A1NPC1RAB9ASMN1; SMN2KDM4E
SCHEMBL11592819 0.76 KDM4E (0.37) ALDH1A1NPC1RAB9ASMN1; SMN2KDM4E
SCHEMBL11541708 0.75 NPC1 (0.46) ALDH1A1NPC1RAB9ASMN1; SMN2KDM4E

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
US-4179548-A UV curable resin compositions containing urethanes of hydroxybenzotriazoles or urethanes of hydroxy benzophenones GENERAL ELECTRIC COMPANY (US) 1979-12-18 US disclosed
US-4061652-A Urethanes of hydroxybenzotriazoles GENERAL ELECTRIC COMPANY (US) 1977-12-06 US disclosed