SCHEMBL3850436

SCHEMBL3850436

Cc1cc(-n2ccnc2)ccc1C(=O)O

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADH5 P11766 10/20 0.67
PDE4A P27815 2/20 0.57
PDE4B Q07343 2/20 0.57
PDE4C Q08493 2/20 0.57
PDE4D Q08499 2/20 0.57
CYP3A4 P08684 1/20 0.56
BAZ2B Q9UIF8 1/20 0.56
HTT P42858 1/20 0.52
MAPT P10636 2/20 0.52
LMNA P02545 1/20 0.52
DHODH Q02127 1/20 0.50
HTR2A P28223 1/20 0.48
HTR2C P28335 1/20 0.48
HTR2B P41595 1/20 0.48
ENPP2 Q13822 1/20 0.47
MKNK1 Q9BUB5 1/20 0.47
MKNK2 Q9HBH9 1/20 0.47
KDM4E B2RXH2 1/20 0.47
MEN1 O00255 1/20 0.47
MITF O75030 1/20 0.47

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
SCHEMBL5800531 0.82 PDE4A (0.52) ADH5PDE4APDE4BPDE4CPDE4D
SCHEMBL26614123 0.82 ADH5 (0.54) ADH5CYP3A4BAZ2BHTTMAPT
SCHEMBL15924858 0.82 ADH5 (0.64) ADH5CYP3A4BAZ2BDHODHENPP2
SCHEMBL12316378 0.81 CYP11B1 (0.52) ADH5CYP3A4BAZ2BHTTMAPT
SCHEMBL17630071 0.81 ADH5 (1.00) ADH5PDE4APDE4BPDE4CPDE4D
SCHEMBL26614180 0.79 ADH5 (0.54) ADH5CYP3A4BAZ2BHTTMAPT
SCHEMBL12117429 0.79 CYP11B1 (0.56) ADH5CYP3A4BAZ2BMAPTLMNA
SCHEMBL5806043 0.78 CYP11B1 (0.52) ADH5CYP3A4BAZ2BHTTMAPT
SCHEMBL28815194 0.78 ADH5 (0.62) ADH5PDE4APDE4BPDE4CPDE4D
SCHEMBL6948718 0.78 MAP2K1 (0.48) ADH5PDE4APDE4BPDE4CPDE4D

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 38 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2085086-A2 Method for treating congestive heart failure or diabetic nephropathy Synvista Therapeutics, Inc. (US) 2009-08-05 EP disclosed
US-20090124673-A1 Method for treating diabetic nephropathy SYNVISTA THERAPEUTICS , INC. (US) 2009-05-14 US disclosed
US-20090124674-A1 Method for treating congestive heart failure SYNVISTA THERAPEUTICS, INC. (US) 2009-05-14 US disclosed
US-7432254-B2 Method for treating glaucoma IC SYNVISTA THERAPEUTICS, INC. (US) 2008-10-07 US disclosed
EP-1353669-B1 METHOD FOR TREATING GLAUCOMA ALTEON INC (US) 2007-08-15 EP disclosed
US-20070161616-A1 Method for treating glaucoma IIB SYNVISTA THERAPEUTICS, INC. 2007-07-12 US disclosed
EP-1785134-A2 Thiazole, imidazole and oxazole compounds and treatments of disorders associated with protein aging ALTEON, INC. (US) 2007-05-16 EP disclosed
US-20070043016-A1 Method of treating fibrotic diseases or other indications with imidazolium agents SYNVISTA THERAPEUTICS, INC. 2007-02-22 US disclosed
US-7166625-B2 Method for treating fibrotic diseases and other indications ALTEON, INC. (US) 2007-01-23 US disclosed
EP-1359910-A4 METHOD FOR TREATING GLAUCOMA II B ALTEON INC (US) 2006-07-05 EP disclosed
US-20020160993-A1 Method for treating glaucoma IC SYNVISTA THERAPEUTICS, INC. 2002-10-31 US disclosed
EP-1248615-A1 THIAZOLE, IMIDAZOLE AND OXAZOLE COMPOUNDS AND TREATMENTS OF DISORDERS ASSOCIATED WITH PROTEIN AGING Alteon, Inc. (US) 2002-10-16 EP disclosed
US-20020119970-A1 Method for treating glaucoma IIB SYNVISTA THERAPEUTICS, INC. 2002-08-29 US disclosed
WO-2002053158-A1 METHOD FOR TREATING GLAUCOMA IB ALTEON, INC. (US) 2002-07-11 WO disclosed
WO-2002053156-A1 METHOD FOR TREATING GLAUCOMA II B ALTEON, INC. (US) 2002-07-11 WO disclosed
WO-2002053161-A1 METHOD FOR TREATING FIBROTIC DISEASES OR OTHER INDICATIONS ALTEON, INC. (US) 2002-07-11 WO disclosed
US-20020068729-A1 Method for treating fibrotic diseases or other indications IC ALTEON, INC. 2002-06-06 US disclosed
US-20020022622-A1 Thiazole, imidazole and oxazole compounds and treatments of disorders associated with protein aging SYNVISTA THERAPEUTICS, INC. 2002-02-21 US disclosed
WO-2002007725-A1 METHOD FOR TREATING FIBROTIC DISEASES OR OTHER INDICATIONS IC ALTEON, INC. (US) 2002-01-31 WO disclosed
WO-2001052847-A1 THIAZOLE, IMIDAZOLE AND OXAZOLE COMPOUNDS AND TREATMENTS OF DISORDERS ASSOCIATED WITH PROTEIN AGING ALTEON, INC. (US) 2001-07-26 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (8 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070161616-A1 Method for treating glaucoma IIB NDUFB9, NDUFB2, NDUFB7 ADH5 2265/4885PDE4A 981/4885PDE4B 604/4885
US-20020022622-A1 Thiazole, imidazole and oxazole compounds and treatments of disorders associated with protein aging ABAT, NDUFAB1, HSPE1 ADH5 1235/4885PDE4A 1914/4885PDE4B 2600/4885
US-20020160993-A1 Method for treating glaucoma IC CHAT, MYOC, GAP43 ADH5 2498/4885PDE4A 435/4885PDE4B 542/4885
US-20020068729-A1 Method for treating fibrotic diseases or other indications IC MMP1, COL1A1, COL2A1 ADH5 1640/4885PDE4A 1380/4885PDE4B 1421/4885
US-20090124673-A1 Method for treating diabetic nephropathy REN, SLC5A2, SLC5A1 ADH5 1158/4885PDE4A 777/4885PDE4B 872/4885
US-20020119970-A1 Method for treating glaucoma IIB NDUFB9, NDUFB2, NDUFB7 ADH5 2342/4885PDE4A 1414/4885PDE4B 1048/4885
US-20070043016-A1 Method of treating fibrotic diseases or other indications with imidazolium agents MMP1, COL1A1, EPX ADH5 1563/4885PDE4A 3166/4885PDE4B 3427/4885
US-20090124674-A1 Method for treating congestive heart failure TNNI3, TNNT2, FABP3 ADH5 1022/4885PDE4A 736/4885PDE4B 887/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.