SCHEMBL670289

SCHEMBL670289

CC(CCCCCCCC(=O)Cl)C(=O)Cl

nearest known ligand 0.52

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.52
TSHR P16473 2/20 0.52
TP53 P04637 1/20 0.44
LTA4H P09960 1/20 0.41
FFAR4 Q5NUL3 1/20 0.38
FFAR1 O14842 1/20 0.38
CA1 P00915 2/20 0.38
ACE2 Q9BYF1 1/20 0.34
FAAH O00519 1/20 0.34
KDM4C Q9H3R0 2/20 0.33
KDM4A O75164 1/20 0.33
PHF8 Q9UPP1 1/20 0.33
KDM2A Q9Y2K7 1/20 0.33
TBXA2R P21731 1/20 0.33
PTGFR P43088 1/20 0.33
PTGER2 P43116 1/20 0.33
GPR84 Q9NQS5 1/20 0.32
BLM P54132 1/20 0.32
CYP1A2 P05177 1/20 0.32

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
SCHEMBL494013 1.00 ALDH1A1 (0.52) ALDH1A1TSHRTP53LTA4HFFAR4
SCHEMBL495059 1.00 ALDH1A1 (0.52) ALDH1A1TSHRTP53LTA4HFFAR4
SCHEMBL494900 1.00 ALDH1A1 (0.52) ALDH1A1TSHRTP53LTA4HFFAR4
SCHEMBL495948 1.00 ALDH1A1 (0.52) ALDH1A1TSHRTP53LTA4HFFAR4
SCHEMBL494087 1.00 ALDH1A1 (0.52) ALDH1A1TSHRTP53LTA4HFFAR4
SCHEMBL495251 1.00 ALDH1A1 (0.52) ALDH1A1TSHRTP53LTA4HFFAR4
SCHEMBL3059308 1.00 ALDH1A1 (0.52) ALDH1A1TSHRTP53LTA4HFFAR4
SCHEMBL495140 1.00 ALDH1A1 (0.52) ALDH1A1TSHRTP53LTA4HFFAR4
SCHEMBL494185 1.00 ALDH1A1 (0.52) ALDH1A1TSHRTP53LTA4HFFAR4
SCHEMBL495750 1.00 ALDH1A1 (0.52) ALDH1A1TSHRTP53LTA4HFFAR4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118356812-A Ternary polymerization polyamide composite membrane and preparation method and application thereof 南京工业大学 2024-07-19 CN claimed
CN-118356812-A Ternary polymerization polyamide composite membrane and preparation method and application thereof 南京工业大学 2024-07-19 CN disclosed
EP-2605769-B1 BENZOQUINONE DERIVATIVES FOR THE TREATMENT OF MITCHONDRIAL EYE DISEASES SANTHERA PHARMACEUTICALS CH (CH) 2016-07-27 EP disclosed
EP-2605769-A2 BENZOQUINONE DERIVATIVES AS MODULATORS OF MITCHONDRIAL FUNCTION Santhera Pharmaceuticals (Schweiz) AG (CH) 2013-06-26 EP disclosed
EP-2606022-A2 NOVEL BENZOQUINONE DERIVATIVES AND USE THEREOF AS MODULATORS OF MITOCHONDRIAL FUNCTION Santhera Pharmaceuticals (Schweiz) AG (CH) 2013-06-26 EP disclosed
WO-2012022468-A2 BENZOQUINONE DERIVATIVES AS MODULATORS OF MITCHONDRIAL FUNCTION SANTHERA PHARMACEUTICALS (SCHWEIZ) AG (CH) 2012-02-23 WO disclosed
WO-2012022467-A2 NOVEL BENZOQUINONE DERIVATIVES AND USE THEREOF AS MODULATORS OF MITOCHONDRIAL FUNCTION SANTHERA PHARMACEUTICALS (SCHWEIZ) AG (CH) 2012-02-23 WO disclosed
US-7772402-B2 Optically detectable organophosphonates AUSTRIA WIRTSCHAFTSSERVICE GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (AT) 2010-08-10 US disclosed
US-20090258422-A1 OPTICALLY DETECTABLE ORGANOPHOSPHONATES AUSTRIA WIRTSCHAFTSSERVICE GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (AT) 2009-10-15 US disclosed
US-7601845-B2 Optically detectable organophosphonates AUSTRIA WIRTSCHAFTSSERVICE GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (AT) 2009-10-13 US disclosed
EP-1603927-B1 OPTICALLY DETECTABLE (ALKYLACYL-2-AMINODESOXY-GLYCERO)-NITROPHENYL-PHOSPHONATES AUSTRIA WIRTSCHAFTSSERV GMBH (AT) 2008-08-20 EP disclosed
US-20060134715-A1 Optically detectable organophosphonates AUSTRIA WIRTSCHAFTSSERVICE GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (AT) 2006-06-22 US disclosed
EP-1603927-A1 OPTICALLY DETECTABLE (ALKYLACYL-2-AMINODESOXY-GLYCERO)-NITROPHENYL-PHOSPHONATES Austria Wirtschaftsservice Gesellschaft mit beschränkter Haftung (AT) 2005-12-14 EP disclosed
WO-2004083220-A1 OPTICALLY DETECTABLE (ALKYLACYL-2-AMINODESOXY-GLYCERO)-NITROPHENYL-PHOSPHONATES Austria Wirtschaftsservice Gesellschaft mit beschränkter Haftung (AT) 2004-09-30 WO disclosed
US-5942387-A Combinatorial process for preparing substituted thiophene libraries ELI LILLY AND COMPANY (US) 1999-08-24 US disclosed
EP-0825164-A2 Scavenger assisted combinatorial process for preparing libraries of amides, carbamates and sulfonamides ELI LILLY AND COMPANY (US) 1998-02-25 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-20090258422-A1 OPTICALLY DETECTABLE ORGANOPHOSPHONATES LYPLA1, CES1, LIPE ALDH1A1 1008/4885TSHR 2812/4885TP53 4438/4885
US-20060134715-A1 Optically detectable organophosphonates LYPLA1, CES1, LIPE ALDH1A1 1008/4885TSHR 2812/4885TP53 4438/4885

“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.