SCHEMBL6624656

SCHEMBL6624656

CCOC(=O)c1[nH]c2c(C#N)cnn2c(=O)c1CCO

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 13/20 0.46
▸ ALDH1A1 P00352 7/20 0.46
▸ HPGD P15428 4/20 0.46
▸ HSD17B10 Q99714 2/20 0.46
▸ POLB P06746 3/20 0.44
▸ HTT P42858 1/20 0.44
▸ RECQL P46063 1/20 0.44
▸ KDM5A P29375 2/20 0.41
▸ HIF1A Q16665 2/20 0.37
▸ RAB9A P51151 1/20 0.37
▸ CYP2C9 P11712 1/20 0.37
▸ KMT2A Q03164 5/20 0.37
▸ MEN1 O00255 3/20 0.37
▸ MAPT P10636 3/20 0.37
▸ RXFP1 Q9HBX9 1/20 0.37
▸ GLA P06280 2/20 0.35
▸ ATM Q13315 1/20 0.35
▸ GAA P10253 1/20 0.35
▸ STAT6 P42226 1/20 0.35
▸ LMNA P02545 1/20 0.34

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
SCHEMBL16047337 0.93 KDM4E (0.47) KDM4EALDH1A1HPGDHSD17B10POLB
SCHEMBL16047833 0.90 KDM4E (0.48) KDM4EALDH1A1HPGDHSD17B10POLB
SCHEMBL9204181 0.82 KDM4E (0.45) KDM4EALDH1A1HPGDHSD17B10POLB
SCHEMBL6623532 0.78 PLAT (0.42) KDM4EALDH1A1HPGDHSD17B10POLB
SCHEMBL16046974 0.78 RAB9A (0.50) KDM4EALDH1A1HPGDHSD17B10POLB
SCHEMBL16077829 0.77 KDM4E (0.51) KDM4EALDH1A1HPGDHSD17B10POLB
SCHEMBL16048319 0.76 KDM5A (0.49) KDM4EALDH1A1HPGDHSD17B10POLB
SCHEMBL16092385 0.75 KDM5A (0.48) KDM4EALDH1A1HPGDHSD17B10POLB
SCHEMBL8177312 0.74 KDM4E (0.53) KDM4EALDH1A1HPGDHSD17B10POLB
SCHEMBL8186888 0.74 HTR6 (0.39) KDM4EALDH1A1HPGDHSD17B10POLB

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0976754-B1 REMEDIES/PREVENTIVES FOR RESPIRATORY DISEASES POLA CHEM IND INC (JP) 2004-07-14 — — EP disclosed
US-6329382-B1 TREATMENT OF RESPIRATORY DISEASES POLA CHEMICAL INDUSTRIES, INC. (JP) 2001-12-11 — — US disclosed
EP-0976754-A1 REMEDIES/PREVENTIVES FOR RESPIRATORY DISEASES POLA CHEMICAL INDUSTRIES, INC. (JP) 2000-02-02 — — EP disclosed
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