SCHEMBL96171

SCHEMBL96171

O=[C]OCCCc1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 1/20 0.55
LMNA P02545 1/20 0.52
SMN1; SMN2 Q16637 2/20 0.46
FFAR1 O14842 1/20 0.46
NPC1 O15118 1/20 0.46
RECQL P46063 1/20 0.46
RAB9A P51151 1/20 0.46
HDAC3 O15379 1/20 0.45
MAPK1 P28482 1/20 0.45
ADRA1A P35348 1/20 0.45
HDAC4 P56524 1/20 0.45
SLC6A3 Q01959 1/20 0.45
HDAC1 Q13547 1/20 0.45
HDAC7 Q8WUI4 1/20 0.45
HDAC2 Q92769 1/20 0.45
HDAC10 Q969S8 1/20 0.45
HDAC11 Q96DB2 1/20 0.45
HDAC8 Q9BY41 1/20 0.45
HDAC6 Q9UBN7 1/20 0.45
HDAC9 Q9UKV0 1/20 0.45

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
SCHEMBL2516 0.94 IDO1 (0.48) IDO1LMNASMN1; SMN2FFAR1HDAC3
SCHEMBL99521 0.93 MEN1 (0.49) IDO1LMNASMN1; SMN2FFAR1NPC1
SCHEMBL5544955 0.93 MEN1 (0.49) IDO1LMNASMN1; SMN2FFAR1NPC1
SCHEMBL11108660 0.92 MAPT (0.48) IDO1LMNAFFAR1SIGMAR1MAOA
SCHEMBL97331 0.92 MAPT (0.48) IDO1LMNAFFAR1SIGMAR1MAOA
SCHEMBL96961 0.92 MAPT (0.48) IDO1LMNAFFAR1SIGMAR1MAOA
SCHEMBL11103088 0.92 MAPT (0.48) IDO1LMNAFFAR1SIGMAR1MAOA
SCHEMBL11103301 0.92 MAPT (0.48) IDO1LMNAFFAR1SIGMAR1MAOA
SCHEMBL11102439 0.92 MAPT (0.48) IDO1LMNAFFAR1SIGMAR1MAOA
SCHEMBL5542416 0.91 MEN1 (0.47) IDO1LMNASMN1; SMN2FFAR1NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104363756-A Agricultural plant-protecting agent containing dipeptide derivative as active ingredient RURAL DEV ADMIN 2015-02-18 CN claimed
US-20090318502-A1 Pharmaceutical Compositions Comprising a Hypoglycemic Agent and Methods of Using Same INTRANASAL THERAPEUTICS, INC. (US) 2009-12-24 US claimed
CN-101480501-A Substitute material for repairing articular cartilage and preparation method UNIV SICHUAN (CN) 2009-07-15 CN claimed
WO-2007111933-A2 PHARMACEUTICAL COMPOSITIONS COMPRISING A HYPOGLYCEMIC AGENT AND METHODS OF USING SAME INTRANASAL THERAPEUTICS , INC. (US) 2007-10-04 WO claimed
EP-1322608-B1 DELTA1-PYRROLINES USED AS PESTICIDES BAYER CROPSCIENCE AG (DE) 2007-05-02 EP claimed
US-6995185-B2 Δ1-pyrrolines used as pesticides BAYER CROPSCIENCE AG (DE) 2006-02-07 US claimed
CN-1227228-C Delta as pesticide1-pyrrolines BAYER CROPSCIENCE AG (DE) 2005-11-16 CN claimed
EP-1494700-A2 CASPASE INHIBITORS FOR THE TREATMENT OF DISEASES AND CONDITIONS CAUSED BY EXPOSURE TO RADIONUCLIDES, BIOLOGICAL AGENTS, OR CHEMICAL AGENTS Cytovia, Inc. (US) 2005-01-12 EP claimed
US-20040068122-A1 Delta1-pyrrolines used as pesticides BAYER CROPSCIENCE AG (DE) 2004-04-08 US claimed
CN-1476430-A Delta as pesticide1-pyrrolines �ݶ�ũ�����ѧ�ɷݹ�˾ 2004-02-18 CN claimed
WO-2004002401-A2 CASPASE INHIBITORS FOR THE TREATMENT OF DISEASES AND CONDITIONS CAUSED BY EXPOSURE TO RADIONUCLIDES, BIOLOGICAL AGENTS, OR CHEMICAL AGENTS CYTOVIA, INC. (US) 2004-01-08 WO claimed
EP-1322608-A1 DELTA1-PYRROLINES USED AS PESTICIDES Bayer CropScience AG (DE) 2003-07-02 EP claimed
EP-1177168-A4 CASPASE INHIBITORS AND THE USE THEREOF CYTOVIA INC (US) 2003-06-25 EP claimed
JP-2002541237-A 2002-12-03 JP claimed
WO-2002024646-A1 DELTA1-PYRROLINES USED AS PESTICIDES BAYER CROPSCIENCE AG (DE) 2002-03-28 WO claimed
EP-1177168-A1 CASPASE INHIBITORS AND THE USE THEREOF Cytovia, Inc. (US) 2002-02-06 EP claimed
WO-2000061542-A1 CASPASE INHIBITORS AND THE USE THEREOF CYTOVIA, INC. (US) 2000-10-19 WO claimed
WO-2024075815-A1 8-HYDROXYQUINOLINE COMPOUND AND USE THEREOF 国立大学法人大阪大学 2024-04-11 WO disclosed
US-4199570-A AZETIDINE, PYRROLIDINE, OR PIPERIDINE SHIONOGI & CO., LTD. (JP) 1980-04-22 US disclosed
EP-0001280-A2 1-N-acylated-4-O-glycosyl-6-O-glycosyl-1,3-diaminocyclitol derivatives, process for their preparation and pharmaceutical compositions containing them SHIONOGI & CO., LTD. (JP) 1979-04-04 EP 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 (2 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-20040068122-A1 Delta1-pyrrolines used as pesticides DDT, ADRA1D, OPRD1 IDO1 342/4885LMNA 3251/4885SMN1; SMN2 1679/4885
US-20090318502-A1 Pharmaceutical Compositions Comprising a Hypoglycemic Agent and Methods of Using Same IAPP, GPR119, SLC5A2 IDO1 3450/4885LMNA 3274/4885SMN1; SMN2 2116/4885

“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.