SCHEMBL14917528

SCHEMBL14917528

Cc1ccc(NC(C)(O)c2ccccc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 2/20 0.47
▸ MEN1 O00255 5/20 0.44
▸ KMT2A Q03164 5/20 0.44
▸ NPC1 O15118 4/20 0.42
▸ RAB9A P51151 4/20 0.42
▸ SMN1; SMN2 Q16637 4/20 0.42
▸ MAPT P10636 2/20 0.42
▸ HTT P42858 3/20 0.40
▸ PTGS2 P35354 1/20 0.40
▸ KIF11 P52732 3/20 0.39
▸ ALDH1A1 P00352 3/20 0.38
▸ LMNA P02545 2/20 0.38
▸ POLB P06746 2/20 0.38
▸ NPSR1 Q6W5P4 2/20 0.38
▸ XBP1 P17861 1/20 0.38
▸ MAPK1 P28482 1/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ TSHR P16473 2/20 0.37
▸ ALOX12 P18054 1/20 0.37
▸ ACHE P22303 1/20 0.37

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
SCHEMBL14916526 0.88 ALDH1A1 (0.41) KMT2AMAPTALDH1A1NPSR1MAPK1
SCHEMBL12974365 0.80 HPGD (0.50) HPGDMEN1KMT2ANPC1RAB9A
SCHEMBL1248173 0.77 TDP1 (0.44) HPGDMEN1KMT2ANPC1RAB9A
SCHEMBL4457147 0.73 MEN1 (0.50) MEN1KMT2ASMN1; SMN2HTTKIF11
SCHEMBL10776423 0.72 HPGD (0.68) HPGDMEN1KMT2ANPC1RAB9A
SCHEMBL10951232 0.72 HPGD (0.68) HPGDMEN1KMT2ANPC1RAB9A
SCHEMBL902711 0.72 NPSR1 (0.44) HPGDMEN1KMT2ASMN1; SMN2MAPT
SCHEMBL10790255 0.72 ALDH1A1 (0.46) KMT2ASMN1; SMN2MAPTALDH1A1MAPK1
SCHEMBL10799298 0.72 HPGD (0.45) HPGDMEN1KMT2ANPC1RAB9A
SCHEMBL13453016 0.71 MEN1 (0.47) MEN1KMT2ASMN1; SMN2HTTKIF11

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-8932980-B2 Ordered mesoporous titanosilicate and the process for the preparation thereof COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2015-01-13 — — US disclosed
US-20130116453-A1 ORDERED MESOPOROUS TITANOSILICATE AND THE PROCESS FOR THE PREPARATION THEREOF COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2013-05-09 — — US disclosed
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