SCHEMBL8834947

SCHEMBL8834947

CSc1ccc2ncccc2c1N

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 3/20 0.59
▸ LMNA P02545 2/20 0.59
▸ HSP90AA1 P07900 2/20 0.59
▸ HSP90AB1 P08238 2/20 0.59
▸ HTT P42858 2/20 0.59
▸ MEN1 O00255 1/20 0.59
▸ BLM P54132 1/20 0.59
▸ KMT2A Q03164 1/20 0.59
▸ HIF1A Q16665 1/20 0.59
▸ KDM4E B2RXH2 3/20 0.52
▸ CYP3A4 P08684 1/20 0.43
▸ AR P10275 1/20 0.40
▸ NCF1 P14598 1/20 0.40
▸ NR4A2 P43354 1/20 0.39
▸ SMN1; SMN2 Q16637 3/20 0.38
▸ ALDH1A1 P00352 2/20 0.38
▸ CASP1 P29466 2/20 0.38
▸ HSD17B10 Q99714 2/20 0.38
▸ TP53 P04637 1/20 0.38
▸ TSHR P16473 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
SCHEMBL29661833 0.80 MAPT (0.54) MAPTLMNAHSP90AA1HSP90AB1HTT
SCHEMBL20675599 0.80 MAPT (0.54) MAPTLMNAHSP90AA1HSP90AB1HTT
SCHEMBL22288125 0.80 MAPT (0.54) MAPTLMNAHSP90AA1HSP90AB1HTT
SCHEMBL25536192 0.79 MAPT (0.52) MAPTLMNAHSP90AA1HSP90AB1HTT
SCHEMBL15700707 0.76 MAPT (0.52) MAPTLMNAHSP90AA1HSP90AB1HTT
SCHEMBL3343150 0.76 LMNA (0.66) MAPTLMNAHSP90AA1HSP90AB1HTT
SCHEMBL1085388 0.75 MAPT (1.00) MAPTLMNAHSP90AA1HSP90AB1HTT
SCHEMBL29661896 0.75 MAPT (1.00) MAPTLMNAHSP90AA1HSP90AB1HTT
SCHEMBL25247480 0.75 MAPT (0.47) MAPTLMNAHSP90AA1HSP90AB1HTT
SCHEMBL8856164 0.74 HSP90AA1 (0.42) MAPTLMNAHSP90AA1HSP90AB1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5656634-A N-aryl and N-heteroarylamide and urea derivatives as inhibitors of acyl coenzyme A: cholesterol acyl transferase (ACAT) PFIZER INC. (US) 1997-08-12 — — US disclosed
US-5596001-A 4-aryl-3-(heteroarylureido)quinoline derivatves PFIZER INC. (US) 1997-01-21 — — US disclosed
US-5498786-A Synthesis of intermediates in the preparation of ACAT inhibitors PFIZER INC. (US) 1996-03-12 — — US disclosed
EP-0569482-B1 SYNTHESIS OF INTERMEDIATES IN THE PREPARATION OF ACAT INHIBITORS PFIZER (US) 1995-08-02 — — EP disclosed
EP-0418071-B1 New N-aryl and N-heteroarylamide and urea derivatives as inhibitors of acyl coenzyme A: cholesterol acyl transferase PFIZER (US) 1995-04-26 — — EP disclosed
WO-1994026738-A1 N'-HETEROCYCLYL-N-BENZOFURANYL UREA DERIVATIVES AND THEIR ANALOGS AS ACAT INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1994-11-24 — — WO disclosed
US-5362878-A Intermediates for making N-aryl and N-heteroarylamide and urea derivatives as inhibitors of acyl coenzyme A: cholesterol acyl transferase (ACAT) PFIZER INC. (US) 1994-11-08 — — US disclosed
EP-0609960-A1 New N-heteroarylamide derivatives as inhibitors of acyl coenzyme A: cholestrol acyl transferase PFIZER INC. (US) 1994-08-10 — — EP disclosed
EP-0590094-A1 4-ARYL-3-(HETEROARYLUREIDO)QUINOLINE DERIVATIVES PFIZER INC. (US) 1994-04-06 — — EP disclosed
WO-1992019614-A1 4-ARYL-3-(HETEROARYLUREIDO)QUINOLINE DERIVATIVES PFIZER INC. (US) 1992-11-12 — — WO disclosed
WO-1992013843-A1 SYNTHESIS OF INTERMEDIATES IN THE PREPARATION OF ACAT INHIBITORS PFIZER INC. (US) 1992-08-20 — — WO disclosed
WO-1991004027-A1 NEW N-ARYL AND N-HETEROARYLAMIDE AND UREA DERIVATIVES AS INHIBITORS OF ACYL COENZYME A: CHOLESTEROL ACYL TRANSFERASE (ACAT) PFIZER INC. (US) 1991-04-04 — — WO disclosed
EP-0418071-A2 New N-aryl and N-heteroarylamide and urea derivatives as inhibitors of acyl coenzyme A: cholesterol acyl transferase PFIZER INC. (US) 1991-03-20 — — EP disclosed
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