SCHEMBL10910179

SCHEMBL10910179

COC(C)N(CC(=O)OCc1ccccc1)c1cccc(C)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 4/20 0.42
▸ NPC1 O15118 3/20 0.42
▸ ALDH1A1 P00352 3/20 0.42
▸ HTT P42858 2/20 0.42
▸ JAK2 O60674 1/20 0.42
▸ PAX8 Q06710 1/20 0.42
▸ KMT2A Q03164 4/20 0.41
▸ MEN1 O00255 3/20 0.41
▸ POLB P06746 1/20 0.41
▸ MAPK1 P28482 1/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ LMNA P02545 3/20 0.39
▸ CTSK P43235 2/20 0.38
▸ USP2 O75604 1/20 0.38
▸ CTSL P07711 1/20 0.38
▸ CTSS P25774 1/20 0.38
▸ MAPT P10636 2/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ KEAP1 Q14145 1/20 0.37
▸ NFE2L2 Q16236 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
SCHEMBL10787316 0.80 ALDH1A1 (0.47) RAB9ANPC1ALDH1A1HTTJAK2
SCHEMBL10788300 0.78 ALDH1A1 (0.45) RAB9ANPC1ALDH1A1HTTJAK2
SCHEMBL10908908 0.77 RAB9A (0.42) RAB9ANPC1ALDH1A1HTTJAK2
SCHEMBL10908501 0.74 RAB9A (0.42) RAB9ANPC1ALDH1A1HTTJAK2
SCHEMBL22828131 0.73 KMT2A (0.44) RAB9ANPC1ALDH1A1HTTJAK2
SCHEMBL11321042 0.72 MAPT (0.43) ALDH1A1HTTKMT2AMEN1POLB
SCHEMBL10784602 0.71 ALDH1A1 (0.47) RAB9ANPC1ALDH1A1HTTJAK2
SCHEMBL21012091 0.71 ALDH1A1 (0.69) RAB9ANPC1ALDH1A1KMT2APOLB
SCHEMBL11679587 0.71 TP53 (0.44) RAB9ANPC1ALDH1A1HTTJAK2
SCHEMBL23422467 0.71 ALDH1A1 (0.40) ALDH1A1MAPK1LMNASMN1; SMN2KEAP1

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-4564673-A 3-Cyano-5-nitrothiophene anilino monoazo dye for synthetic fibers RESEARCH ASSOCIATION OF SYNTHETIC DYESTUFFS (JP) 1986-01-14 — — US disclosed
EP-0109857-A1 Monoazo dye for synthetic fibers RESEARCH ASSOCIATION OF SYNTHETIC DYESTUFFS (JP) 1984-05-30 — — EP disclosed
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