SCHEMBL6002977

SCHEMBL6002977

CCOCC(=O)N(C1CCCCC1)C1CC1

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 4/20 0.48
▸ MEN1 O00255 3/20 0.48
▸ ALDH1A1 P00352 5/20 0.47
▸ TSHR P16473 2/20 0.47
▸ POLB P06746 1/20 0.47
▸ MAPK1 P28482 1/20 0.47
▸ ADH1C P00326 1/20 0.40
▸ ADH1A P07327 1/20 0.40
▸ LMNA P02545 3/20 0.40
▸ NPSR1 Q6W5P4 1/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ NPC1 O15118 1/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ HSD17B10 Q99714 1/20 0.38

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
SCHEMBL701404 0.88 KMT2A (0.53) KMT2AMEN1ALDH1A1TSHRPOLB
SCHEMBL2842929 0.88 KMT2A (0.53) KMT2AMEN1ALDH1A1TSHRPOLB
SCHEMBL2093629 0.83 KMT2A (0.49) KMT2AMEN1ALDH1A1TSHRPOLB
SCHEMBL2582061 0.82 KMT2A (0.44) KMT2AMEN1ALDH1A1TSHRPOLB
SCHEMBL28645343 0.81 KMT2A (0.48) KMT2AMEN1ALDH1A1TSHRPOLB
SCHEMBL2091299 0.81 KMT2A (0.50) KMT2AMEN1ALDH1A1TSHRPOLB
SCHEMBL9761192 0.81 KMT2A (0.44) KMT2AMEN1ALDH1A1TSHRPOLB
SCHEMBL27206868 0.80 HTR2A (0.46) KMT2AMEN1ALDH1A1TSHRPOLB
SCHEMBL27351033 0.80 KMT2A (0.48) KMT2AMEN1ALDH1A1TSHRPOLB
SCHEMBL29152720 0.80 KMT2A (0.47) KMT2AMEN1ALDH1A1TSHRPOLB

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
EP-1678185-A1 2,3-DIHYDRO-6-NITROIMIDAZO [2,1-B] OXAZOLE COMPOUNDS FOR THE TREATMENT OF TUBERCULOSIS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2006-07-12 — — EP disclosed
WO-2005042542-A1 2,3-DIHYDRO-6-NITROIMIDAZO (2,1-B) OXAZOLE COMPOUNDS FOR THE TREATMENT OF TUBERCULOSIS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2005-05-12 — — WO disclosed
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