SCHEMBL6194384

SCHEMBL6194384

CCCCCc1ccc2[nH]c(=O)ccc2c1

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ CA12 O43570 1/20 0.51
▸ CA9 Q16790 1/20 0.51
▸ F11 P03951 1/20 0.47
▸ GPR84 Q9NQS5 3/20 0.46
▸ POLB P06746 2/20 0.45
▸ MAPT P10636 2/20 0.44
▸ UNG P13051 3/20 0.44
▸ TP53 P04637 1/20 0.43
▸ AR P10275 1/20 0.42
▸ CTSV O60911 1/20 0.42
▸ CTSL P07711 1/20 0.42
▸ HTR1A P08908 1/20 0.42
▸ HTR1D P28221 1/20 0.42
▸ HTR1B P28222 1/20 0.42

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
SCHEMBL18932519 0.89 GPR84 (0.47) CA12CA9GPR84MAPTUNG
SCHEMBL18932514 0.88 GPR84 (0.47) GPR84MAPTUNGCTSVCTSL
SCHEMBL8860929 0.84 F11 (0.51) CA12CA9F11POLBMAPT
SCHEMBL18932524 0.84 GPR84 (0.47) CA12CA9GPR84MAPTTP53
SCHEMBL17505185 0.83 CA12 (0.49) CA12CA9F11POLBMAPT
SCHEMBL764001 0.82 CA12 (0.59) CA12CA9F11POLBMAPT
SCHEMBL20671970 0.78 CA12 (0.51) CA12CA9F11POLBMAPT
SCHEMBL17505149 0.78 POLB (0.45) CA12CA9F11POLBMAPT
SCHEMBL21024968 0.78 CA12 (0.54) CA12CA9F11POLBMAPT
SCHEMBL865468 0.78 HTR1A (0.43) MAPTTP53CTSVCTSLHTR1A

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-1130017-B1 Azole derivatives and their use as superoxide radical inhibitors OTSUKA PHARMA CO LTD (JP) 2005-06-15 — — EP disclosed
EP-0934937-B1 Azole derivatives as superoxide radical inhibitor OTSUKA PHARMA CO LTD (JP) 2002-02-27 — — EP disclosed
US-RE37556-E1 (ALKOXYPHENYL)THIAZOLE DERIVATIVES OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2002-02-19 — — US disclosed
EP-1130017-A2 Azole derivatives and their use as superoxide radical inhibitors OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2001-09-05 — — EP disclosed
US-6080764-A PROTECTING VARIOUS TISSUE CELLS FROM DISTURBANCES ASSOCIATED WITH ISCHEMIA AND BLOOD REPERFUSION IN HEART, BRAIN, KIDNEY, LUNG AND DIGESTIVE TRACT BY INHIBITING SUPEROXIDE-RELEASE BY NEUTROPHILIC LEUKOCYTES OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2000-06-27 — — US disclosed
EP-0934937-A1 Azole derivatives as superoxide radical inhibitor OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1999-08-11 — — EP disclosed
US-5677319-A THIAZOLE DERIVATIVE OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1997-10-14 — — US disclosed
US-5643932-A PREVENTS CELL DAMAGE AFTER ISCHEMIA AND RE-PERFUSION, SUBSTITUTED THIAZOLES OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1997-07-01 — — US disclosed
EP-0513387-A1 ACTIVE OXYGEN INHIBITOR OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1992-11-19 — — EP disclosed
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