SCHEMBL8138977

SCHEMBL8138977

COc1ccc(-c2nc(/C=C\c3nccn3C)nc3cc(OC)c(OC)cc23)cc1OC

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDGFRB P09619 3/20 0.40
▸ PDGFRA P16234 3/20 0.40
▸ WHR1 P49842 2/20 0.39
▸ PIK3CD O00329 2/20 0.38
▸ PIK3CA P42336 2/20 0.38
▸ PIK3CB P42338 2/20 0.38
▸ PIK3CG P48736 2/20 0.38
▸ MTOR P42345 1/20 0.38
▸ PDE10A Q9Y233 1/20 0.38
▸ ALDH1A1 P00352 2/20 0.38
▸ HPGD P15428 2/20 0.38
▸ HIF1A Q16665 1/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ PDE4A P27815 2/20 0.36
▸ PDE4D Q08499 2/20 0.36
▸ KDM4E B2RXH2 2/20 0.35
▸ MAPT P10636 1/20 0.35
▸ KIT P10721 1/20 0.35
▸ GAK O14976 1/20 0.35
▸ HTT P42858 1/20 0.35

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
SCHEMBL8121655 1.00 PDGFRB (0.40) PDGFRBPDGFRAWHR1PIK3CDPIK3CA
SCHEMBL8121649 1.00 PDGFRB (0.40) PDGFRBPDGFRAWHR1PIK3CDPIK3CA
SCHEMBL8131985 0.75 ALDH1A1 (0.37) PDGFRBPDGFRAALDH1A1HPGDHIF1A
SCHEMBL8131979 0.75 ALDH1A1 (0.37) PDGFRBPDGFRAALDH1A1HPGDHIF1A
SCHEMBL8138452 0.75 ALDH1A1 (0.37) PDGFRBPDGFRAALDH1A1HPGDHIF1A
SCHEMBL8492206 0.74 TLR9 (0.39) PDGFRBPDGFRAWHR1PIK3CDPIK3CA
SCHEMBL28050431 0.67 LRRK2 (0.51) PDGFRBPDGFRAALDH1A1HPGDPDE4A
SCHEMBL7819346 0.66 QPCT (0.47) MTORALDH1A1HPGDHIF1APDE4A
SCHEMBL7819852 0.66 WHR1 (0.48) PDGFRBPDGFRAWHR1PIK3CDPIK3CA
SCHEMBL8637407 0.65 PDE4A (0.41) PDGFRBPDGFRAWHR1ALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0634169-B1 Quinoline or quinazoline derivatives and their use in the manufacture of a medicament for the treatment of osteoporosis TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2000-01-05 — — EP disclosed
US-5948782-A ANTIINFLAMMATORY AGENT; RHEUMATIC DISEASES TAKEDA CHEMICAL (JP) 1999-09-07 — — US disclosed
US-5852039-A Pharmaceutical composition containing quinoline or quinazoline derivatives TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1998-12-22 — — US disclosed
US-5719157-A OSTEOPOROSIS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1998-02-17 — — US disclosed
EP-0634169-A1 Pharmaceutical composition containing quinoline or quinazoline derivatives TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1995-01-18 — — EP disclosed
EP-0567107-A1 Quinoline and quinazoline derivatives for treating arthritis TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1993-10-27 — — EP disclosed
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