SCHEMBL7529758

SCHEMBL7529758

N#Cc1ccc(Cc2cnccc2CO)cc1

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP11B2 P19099 9/20 0.51
CYP11B1 P15538 8/20 0.51
HRH3 Q9Y5N1 1/20 0.45
KDM4E B2RXH2 1/20 0.42
ALDH1A1 P00352 1/20 0.42
CYP1A2 P05177 1/20 0.42
CYP2D6 P10635 1/20 0.42
CYP2C9 P11712 1/20 0.42
HPGD P15428 1/20 0.42
CYP2C19 P33261 1/20 0.42
LOXL2 Q9Y4K0 2/20 0.40
SAE1 Q9UBE0 1/20 0.40
UBA2 Q9UBT2 1/20 0.40
CYP19A1 P11511 5/20 0.39
CYP2A6 P11509 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
SCHEMBL7814470 0.83 LOXL2 (0.54) CYP11B2CYP11B1HRH3KDM4EALDH1A1
SCHEMBL7973673 0.79 MEN1 (0.41) KDM4EALDH1A1CYP1A2CYP2D6CYP2C9
SCHEMBL5110350 0.78 CYP11B1 (0.47) CYP11B2CYP11B1KDM4E
SCHEMBL7501498 0.77 CYP11B2 (0.47) CYP11B2CYP11B1HRH3KDM4EALDH1A1
SCHEMBL7527570 0.77 CYP11B2 (0.47) CYP11B2CYP11B1HRH3KDM4EALDH1A1
SCHEMBL7519629 0.75 CYP11B1 (0.51) CYP11B2CYP11B1HRH3KDM4EALDH1A1
SCHEMBL8186726 0.74 CYP11B2 (0.45) CYP11B2CYP11B1HRH3KDM4EALDH1A1
SCHEMBL171234 0.74 HRH3 (0.53) CYP11B2CYP11B1HRH3KDM4EALDH1A1
SCHEMBL29900474 0.73 AOC1 (0.43) CYP11B2CYP11B1KDM4ELOXL2CYP2A6
SCHEMBL6249306 0.73 AOC1 (0.43) CYP11B2CYP11B1KDM4ELOXL2CYP2A6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0900081-A4 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE MERCK & CO INC (US) 2002-01-09 EP disclosed
EP-0891349-A4 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE MERCK & CO INC (US) 2001-01-24 EP disclosed
EP-0891350-A4 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE MERCK & CO INC (US) 2001-01-17 EP disclosed
US-6063930-A Substituted imidazole compounds useful as farnesyl-protein transferase inhibitors MERCK & CO., INC. (US) 2000-05-16 US disclosed
US-5972942-A Inhibitors of farnesyl-protein transferase MERCK & CO., INC. (US) 1999-10-26 US disclosed
US-5919785-A Inhibitors of farnesyl-protein transferase MERCK & CO., INC. (US) 1999-07-06 US disclosed
EP-0921801-A1 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE Merck & Co., Inc. (US) 1999-06-16 EP disclosed
US-5885995-A Inhibitors of farnesyl-protein transferase MERCK & CO., INC. (US) 1999-03-23 US disclosed
EP-0900081-A1 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE Merck & Co., Inc. (US) 1999-03-10 EP disclosed
EP-0891349-A1 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE Merck & Co., Inc. (US) 1999-01-20 EP disclosed
EP-0891350-A1 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE Merck & Co., Inc. (US) 1999-01-20 EP disclosed
US-5859012-A Inhibitors of farnesyl-protein transferase MERCK & CO., INC. (US) 1999-01-12 US disclosed
US-5856326-A ANTITUMOR, ANTICANCER AGENTS MERCK & CO., INC. (US) 1999-01-05 US disclosed
US-5780488-A Inhibitors of farnesyl-protein transferase MERCK & CO., INC. (US) 1998-07-14 US disclosed
EP-0820445-A1 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE Merck & Co., Inc. (US) 1998-01-28 EP disclosed
WO-1997036593-A1 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE MERCK & CO., INC. (US) 1997-10-09 WO disclosed
WO-1997036591-A1 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE MERCK & CO., INC. (US) 1997-10-09 WO disclosed
WO-1997036888-A1 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE MERCK & CO., INC. (US) 1997-10-09 WO disclosed
WO-1997036889-A1 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE MERCK & CO., INC. (US) 1997-10-09 WO disclosed
WO-1996030343-A1 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE MERCK & CO., INC. (US) 1996-10-03 WO disclosed