SCHEMBL7811976

SCHEMBL7811976

CCOC(=O)c1c(CCCn2cncn2)nc2cc(OC)c(OC)cc2c1-c1ccc(OC)c(OC)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SLC10A2 Q12908 3/20 0.51
▸ TUBB4A P04350 1/20 0.43
▸ TUBB P07437 1/20 0.43
▸ TUBA3C P0DPH7 1/20 0.43
▸ TUBA1B P68363 1/20 0.43
▸ TUBA4A P68366 1/20 0.43
▸ TUBB4B P68371 1/20 0.43
▸ TUBB3 Q13509 1/20 0.43
▸ TUBB2A Q13885 1/20 0.43
▸ TUBB8 Q3ZCM7 1/20 0.43
▸ TUBA3E Q6PEY2 1/20 0.43
▸ TUBA1A Q71U36 1/20 0.43
▸ TUBA1C Q9BQE3 1/20 0.43
▸ TUBB6 Q9BUF5 1/20 0.43
▸ TUBB2B Q9BVA1 1/20 0.43
▸ TUBB1 Q9H4B7 1/20 0.43
▸ ALDH1A1 P00352 2/20 0.42
▸ GAA P10253 1/20 0.42
▸ HTT P42858 1/20 0.41
▸ LMNA P02545 1/20 0.40

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
SCHEMBL29366657 0.91 SLC10A2 (0.49) SLC10A2TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL607272 0.91 SLC10A2 (0.49) SLC10A2TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL7817907 0.86 SLC10A2 (0.46) SLC10A2TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL8140255 0.86 ALDH1A1 (0.48) SLC10A2TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL7819869 0.85 SLC10A2 (0.47) SLC10A2TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL7818008 0.85 ALDH1A1 (0.53) SLC10A2TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL7820868 0.85 SLC10A2 (0.51) SLC10A2TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL8628406 0.85 ALDH1A1 (0.44) SLC10A2TUBB4ATUBBTUBA3CTUBA1B
Hydrochloric Acid SCHEMBL7819467 0.85 SLC10A2 (0.46) SLC10A2TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL7820071 0.84 SLC10A2 (0.46) SLC10A2TUBB4ATUBBTUBA3CTUBA1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0608870-B1 Quinoline or quinazoline derivatives, their production and use TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2001-09-05 — — EP 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
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