SCHEMBL7684254

SCHEMBL7684254

CCOC(=O)CC(=O)CCCn1cncn1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGLN3 Q9H6Z9 1/20 0.46
ALDH1A1 P00352 3/20 0.43
POLB P06746 1/20 0.43
MEN1 O00255 1/20 0.43
USP2 O75604 1/20 0.43
TSHR P16473 1/20 0.43
KMT2A Q03164 1/20 0.43
HSD17B10 Q99714 1/20 0.43
RAB9A P51151 1/20 0.39
FAAH O00519 1/20 0.38
MGLL Q99685 1/20 0.38
TLR8 Q9NR97 1/20 0.38
TLR7 Q9NYK1 1/20 0.38
MGAM O43451 1/20 0.38
GAA P10253 1/20 0.38
SI P14410 1/20 0.38
MGAM2 Q2M2H8 1/20 0.38
TNF P01375 1/20 0.37
HSP90AA1 P07900 1/20 0.36
MAPT P10636 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
SCHEMBL7688221 0.96 EGLN3 (0.45) EGLN3ALDH1A1POLBMEN1USP2
SCHEMBL7681770 0.92 EGLN3 (0.53) EGLN3ALDH1A1POLBMEN1USP2
SCHEMBL5929803 0.82 EGLN3 (0.59) EGLN3ALDH1A1POLBMEN1USP2
SCHEMBL2362473 0.76 CYP1A2 (0.46) EGLN3ALDH1A1POLBMEN1KMT2A
SCHEMBL7818459 0.75 TBXAS1 (0.52) EGLN3ALDH1A1GAA
SCHEMBL13995828 0.74 EGLN3 (0.59) EGLN3ALDH1A1MEN1USP2TSHR
SCHEMBL30161886 0.72 EGLN3 (0.62) EGLN3ALDH1A1MEN1USP2TSHR
SCHEMBL7824835 0.71 TBXAS1 (0.55) ALDH1A1
SCHEMBL4476235 0.71 GAA (0.61) ALDH1A1POLBUSP2TSHRKMT2A
SCHEMBL6303688 0.71 GAA (0.61) ALDH1A1POLBUSP2TSHRKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6403606-B1 ANTIINFLAMMATORY, ANTIARTHRITIS, A DRUG FOR INHIBITING BONE RESORPTION, IMMUNOSUPPRESSANT TAKEDA CHEMICAL INDUSTRIES LTD. (JP) 2002-06-11 US disclosed
EP-0608870-B1 Quinoline or quinazoline derivatives, their production and use TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2001-09-05 EP disclosed
US-6046189-A ANTI-INFLAMMATORY DRUG, PARTICULARLY, A DRUG FOR PREVENTING OR TREATING ARTHRITIS, A DRUG FOR INHIBITING BONE RESORPTION, IMMUNOSUPPRESSANT TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2000-04-04 US disclosed
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-5932592-A ETHYL 4-(3,4-DIMETHOXYPHENYL)-6,7-DIMETHOXY-2-(1,2,4-TRIAZOLE-1-YLME THYL)QUINOLINE-3-CARBOXYLATE; ANTIINFLAMMATORY AND ANTIARTHRITIC AGENT TAKEDA CHEMICAL IND., LTD. (JP) 1999-08-03 US disclosed
US-5852039-A Pharmaceutical composition containing quinoline or quinazoline derivatives TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1998-12-22 US disclosed
US-5770602-A REACTING QUIONOZOLINE OR QUINOLINE DERIVATIVES CONTAINING LEAVING GROUPS WITH NITROGEN CONTAINING UNSATURATED CYCLIC GROUP WHICH MAY BE SUBSTITUTED OR UNSUBSTITUTED; ANTIARTHRITIC AGENT TAKEDA CHEMICAL INDUSTRIES (JP) 1998-06-23 US disclosed
US-5719157-A OSTEOPOROSIS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1998-02-17 US disclosed
US-5436247-A Antiinflammatory agents or antiarthritic agents TAKEDA CHEMICAL INDUSTRIES (JP) 1995-07-25 US disclosed
EP-0634169-A1 Pharmaceutical composition containing quinoline or quinazoline derivatives TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1995-01-18 EP disclosed
EP-0608870-A1 Quinoline or quinazoline derivatives, their production and use TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1994-08-03 EP disclosed