SCHEMBL7868426

SCHEMBL7868426

CCOC(=O)c1[nH]nc(-c2ccccc2)c1C(=O)c1ccc(Cl)cc1N

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 4/20 0.50
ALOX15 P16050 3/20 0.50
HPGDS O60760 1/20 0.47
ALDH1A1 P00352 5/20 0.47
CYP1A2 P05177 2/20 0.47
CYP2C19 P33261 2/20 0.47
XBP1 P17861 1/20 0.47
KDM4E B2RXH2 3/20 0.45
CSF1R P07333 1/20 0.45
HSD17B10 Q99714 2/20 0.43
CDC25B P30305 1/20 0.43
LMNA P02545 1/20 0.42
GAA P10253 1/20 0.42
MAPT P10636 1/20 0.42
CYP2C9 P11712 1/20 0.41
PTGES O14684 1/20 0.41
ALOX5 P09917 1/20 0.41
ALPL P05186 1/20 0.41
AURKA O14965 1/20 0.41
MAPK10 P53779 1/20 0.41

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
SCHEMBL7863165 0.85 ALOX15 (0.49) HPGDALOX15ALDH1A1CYP1A2CYP2C19
SCHEMBL27371670 0.85 MAP2K4 (0.41) HPGDALOX15ALDH1A1KDM4ELMNA
SCHEMBL7863072 0.85 HPGDS (0.44) HPGDALOX15HPGDSALDH1A1CYP1A2
SCHEMBL7868363 0.84 ALOX15 (0.54) HPGDALOX15ALDH1A1KDM4ECDC25B
SCHEMBL7871217 0.81 ALOX15 (0.51) HPGDALOX15ALDH1A1XBP1KDM4E
SCHEMBL1753182 0.77 HPGDS (0.60) HPGDHPGDSALDH1A1KDM4EHSD17B10
SCHEMBL7868379 0.75 ALOX15 (0.50) HPGDALOX15ALDH1A1CYP1A2CYP2C19
SCHEMBL1969117 0.73 HPGDS (0.59) HPGDHPGDSALDH1A1KDM4EHSD17B10
SCHEMBL27321802 0.73 RAB9A (0.63) HPGDHPGDSALDH1A1CYP1A2CYP2C19
SCHEMBL1189663 0.72 ABL1 (0.68) HPGDALOX15ALDH1A1KDM4EHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6313290-B1 Azolobenzazepine derivatives and compositions and method of use thereof ZENECA LIMITED (GB) 2001-11-06 US disclosed
US-6124281-A TREATING STROKES ZENECA LIMITED (GB) 2000-09-26 US disclosed
EP-0888350-A1 AZOLOBENZAZEPINE DERIVATIVES AS NEUROLOGICALLY ACTIVE AGENTS ZENECA LIMITED (GB) 1999-01-07 EP disclosed
WO-1997032883-A1 AZOLOBENZAZEPINE DERIVATIVES AS NEUROLOGICALLY ACTIVE AGENTS ZENECA LIMITED (GB) 1997-09-12 WO disclosed