SCHEMBL7429605

SCHEMBL7429605

CCOC(=O)CCc1c(C)nc(COC)nc1Cl

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.43
TSHR P16473 2/20 0.43
ALDH1A1 P00352 4/20 0.42
HSD17B10 Q99714 3/20 0.42
KDM4E B2RXH2 6/20 0.40
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
RXFP1 Q9HBX9 1/20 0.39
POLB P06746 3/20 0.38
MAPT P10636 3/20 0.38
HPGD P15428 3/20 0.36
GAA P10253 1/20 0.36
CYP4F2 P78329 1/20 0.36
CYP4A11 Q02928 1/20 0.36

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
SCHEMBL31663340 0.81 TSHR (0.50) L3MBTL1TSHRALDH1A1HSD17B10KDM4E
SCHEMBL8803148 0.81 L3MBTL1 (0.48) L3MBTL1TSHRALDH1A1HSD17B10KDM4E
SCHEMBL5900467 0.80 L3MBTL1 (0.44) L3MBTL1TSHRALDH1A1HSD17B10KDM4E
SCHEMBL7428453 0.72 ALDH1A1 (0.52) L3MBTL1TSHRALDH1A1HSD17B10KDM4E
SCHEMBL7825993 0.71 L3MBTL1 (0.47) L3MBTL1TSHRALDH1A1HSD17B10KDM4E
SCHEMBL27834208 0.71 L3MBTL1 (0.52) L3MBTL1TSHRALDH1A1HSD17B10KDM4E
SCHEMBL27834209 0.70 L3MBTL1 (0.55) L3MBTL1TSHRALDH1A1HSD17B10KDM4E
SCHEMBL22587293 0.70 POLB (0.50) L3MBTL1TSHRALDH1A1HSD17B10KDM4E
SCHEMBL7421184 0.69 DPP4 (0.43) ALDH1A1KDM4EMEN1KMT2ARXFP1
SCHEMBL31663230 0.68 L3MBTL1 (0.49) L3MBTL1TSHRALDH1A1HSD17B10KDM4E

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
EP-0618207-B1 Substituted pyridopyrimidines as antihypertensives AMERICAN HOME PROD (US) 1999-01-07 EP disclosed
EP-0863143-A1 Intermediates useful in the production of pyridopyrimidone angiotensin AII antagonists AMERICAN HOME PRODUCTS CORPORATION (US) 1998-09-09 EP disclosed
US-5466692-A Substituted pyridopyrimidines and antihypertensives AMERICAN HOME PRODUCTS CORPORATION (US) 1995-11-14 US disclosed
EP-0618207-A1 Substituted pyridopyrimidines as antihypertensives AMERICAN HOME PRODUCTS CORPORATION (US) 1994-10-05 EP disclosed