SCHEMBL3860451

SCHEMBL3860451

CC(O)(CO)CCC(O)O

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.32

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
SCHEMBL17687581 0.82 ALDH1A1 (0.30) ALDH1A1
SCHEMBL6758007 0.79 ALDH1A1 (0.39) ALDH1A1
SCHEMBL6758004 0.79 ALDH1A1 (0.39) ALDH1A1
SCHEMBL3630695 0.79 TSHR (0.32) ALDH1A1
SCHEMBL5907149 0.79 ALDH1A1 (0.39) ALDH1A1
SCHEMBL336397 0.75 TSHR (0.44)
SCHEMBL614491 0.75 TDP1 (0.35)
SCHEMBL30345810 0.75
SCHEMBL3411537 0.72
SCHEMBL28594 0.71

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1663231-A4 ORAL ITRACONAZOLE COMPOSITION WHICH IS NOT AFFECTED BY INGESTED FOOD AND PROCESS FOR PREPARING SAME HANMI PHARM IND CO LTD (KR) 2009-04-29 EP disclosed
EP-1663231-A1 ORAL ITRACONAZOLE COMPOSITION WHICH IS NOT AFFECTED BY INGESTED FOOD AND PROCESS FOR PREPARING SAME Hanmi Pharm. Co., Ltd. (KR) 2006-06-07 EP disclosed
WO-2005023262-A1 ORAL ITRACONAZOLE COMPOSITION WHICH IS NOT AFFECTED BY INGESTED FOOD AND PROCESS FOR PREPARING SAME HANMI PHARM. CO., LTD. (KR) 2005-03-17 WO disclosed
WO-2004009584-A1 NOVEL P-GLYCOPROTEIN INHIBITOR, METHOD FOR PREPARING SAME AND ORAL COMPOSITION COMPRISING SAME HANMI PHARM. CO., LTD. (KR) 2004-01-29 WO disclosed
WO-2002013815-A1 ORAL DRUG COMPOSITION CONTAINING A VERAPAMIL DERIVATIVE AS A DRUG-ABSORPTION PROMOTOR HANMI PHARM. CO., LTD. (KR) 2002-02-21 WO disclosed