SCHEMBL27770369

SCHEMBL27770369

CC(=O)ON(Cc1ccccc1)N(Cc1ccccc1)C(N)=O

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.42
NPC1 O15118 3/20 0.40
RAB9A P51151 3/20 0.40
CA12 O43570 1/20 0.40
CA9 Q16790 1/20 0.40
LMNA P02545 1/20 0.39
ALOX5 P09917 1/20 0.38
PTGS1 P23219 1/20 0.38
PTGS2 P35354 1/20 0.38
AOC3 Q16853 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
TSPO P30536 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.37
KMT2A Q03164 3/20 0.37
MEN1 O00255 2/20 0.37
TSHR P16473 1/20 0.37
CRHBP P24387 1/20 0.37
CRHR2 Q13324 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
SCHEMBL5821323 0.74 ALDH1A1 (0.52) ALDH1A1NPC1RAB9ACA12CA9
SCHEMBL10626127 0.74 ALDH1A1 (0.52) ALDH1A1NPC1RAB9ACA12CA9
SCHEMBL432494 0.73 NPC1 (0.52) ALDH1A1NPC1RAB9ACA12CA9
SCHEMBL3187525 0.72 KMT2A (0.46) ALDH1A1LMNASMN1; SMN2L3MBTL1KMT2A
SCHEMBL7035097 0.69 NPC1 (0.54) ALDH1A1NPC1RAB9ACA12CA9
SCHEMBL3244922 0.69 ALDH1A1 (0.46) ALDH1A1NPC1RAB9ACA12CA9
SCHEMBL3244918 0.69 ALDH1A1 (0.46) ALDH1A1NPC1RAB9ACA12CA9
SCHEMBL967112 0.69 NPC1 (0.66) ALDH1A1NPC1RAB9ACA12CA9
SCHEMBL6254668 0.68 NPC1 (0.46) ALDH1A1NPC1RAB9ACA12CA9
SCHEMBL6685647 0.68 LMNA (0.52) ALDH1A1NPC1RAB9ACA12CA9

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
CN-101495120-A Composition for induction or inhibition of stem cell differentiation CHOONGWAE PHARMA CORP (KR) 2009-07-29 CN disclosed