SCHEMBL688511

SCHEMBL688511

O=C(O)C(Cl)CCCCCCCCCCC(Cl)C(=O)O

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TBXAS1 P24557 2/20 0.52
LMNA P02545 1/20 0.42
GPR84 Q9NQS5 3/20 0.41
RNPEP Q9H4A4 1/20 0.41
FFAR1 O14842 1/20 0.41
MAPT P10636 1/20 0.39
LCK P06239 1/20 0.39
PPARD Q03181 1/20 0.39
ZDHHC20 Q5W0Z9 1/20 0.39
ZDHHC2 Q9UIJ5 1/20 0.39
ALDH1A1 P00352 1/20 0.38
GSR P00390 1/20 0.37
CPB2 Q96IY4 2/20 0.37
ACE2 Q9BYF1 1/20 0.37
NOS2 P35228 1/20 0.36
FOLH1 Q04609 1/20 0.35

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
SCHEMBL9620650 1.00 TBXAS1 (0.52) TBXAS1LMNAGPR84RNPEPFFAR1
SCHEMBL9620658 1.00 TBXAS1 (0.52) TBXAS1LMNAGPR84RNPEPFFAR1
SCHEMBL9183195 1.00 TBXAS1 (0.52) TBXAS1LMNAGPR84RNPEPFFAR1
SCHEMBL688373 1.00 TBXAS1 (0.52) TBXAS1LMNAGPR84RNPEPFFAR1
SCHEMBL5844804 1.00 TBXAS1 (0.52) TBXAS1LMNAGPR84RNPEPFFAR1
SCHEMBL689688 1.00 TBXAS1 (0.52) TBXAS1LMNAGPR84RNPEPFFAR1
SCHEMBL5844802 0.97 TBXAS1 (0.48) TBXAS1LMNAGPR84RNPEPFFAR1
SCHEMBL628995 0.91 LMNA (0.44) TBXAS1LMNAGPR84RNPEPALDH1A1
SCHEMBL27413119 0.90 TBXAS1 (0.46) TBXAS1LMNAGPR84RNPEPFFAR1
SCHEMBL11753554 0.90 TBXAS1 (0.46) TBXAS1LMNAGPR84RNPEPFFAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2128122-B1 PROCESS FOR PRODUCING CARBOXYLIC ACID CHLORIDE MITSUI CHEMICALS INC (JP) 2014-01-22 EP disclosed
US-8222446-B2 Method for producing dihydroxybenzene derivative MITSUI CHEMICALS, INC. (JP) 2012-07-17 US disclosed
US-8198482-B2 Method for producing carboxylic acid chloride MITSUI CHEMICALS, INC. (JP) 2012-06-12 US disclosed
EP-1820667-B1 PNEUMATIC TIRE BRIDGESTONE CORP (JP) 2012-02-29 EP disclosed
US-20110004013-A1 METHOD FOR PRODUCING DIHYDROXYBENZENE DERIVATIVE MITSUI CHEMICALS, INC. (JP) 2011-01-06 US disclosed
EP-2269976-A1 PROCESS FOR PRODUCING DIHYDROXYBENZENE DERIVATIVE Mitsui Chemicals, Inc. (JP) 2011-01-05 EP disclosed
US-7823614-B2 Pneumatic tire BRIDGESTONE CORPORATION (JP) 2010-11-02 US disclosed
US-20100099911-A1 METHOD FOR PRODUCING CARBOXYLIC ACID CHLORIDE MITSUI CHEMICALS, INC (JP) 2010-04-22 US disclosed
EP-2128122-A1 PROCESS FOR PRODUCING CARBOXYLIC ACID CHLORIDE Mitsui Chemicals, Inc. (JP) 2009-12-02 EP disclosed
US-20090229728-A1 PNEUMATIC TIRE BRIDGESTONE CORPORATION (JP) 2009-09-17 US disclosed
EP-1820667-A1 PNEUMATIC TIRE Bridgestone Corporation (JP) 2007-08-22 EP disclosed
US-5424349-A Tertiary amides with low volatility and good thermal stability ALBEMARLE CORPORATION (US) 1995-06-13 US disclosed
WO-1992016495-A1 AMIDE ANTIOXIDANTS ETHYL CORPORATION (US) 1992-10-01 WO disclosed
EP-0279978-B1 PHARMACEUTICAL COMPOSITIONS CONTAINING ALPHA-HALOGENATED DICARBOXYLIC ACIDS Epis S.A. (CH) 1992-01-02 EP disclosed
US-4908385-A Pharmaceuticals EPIS S.A. (CH) 1990-03-13 US disclosed
EP-0279978-A1 Pharmaceutical compositions containing alpha-halogenated dicarboxylic acids Epis S.A. (CH) 1988-08-31 EP disclosed
WO-1988002746-A1 MEDICAMENTS CONTAINING ALPHA-HALOGENATED DICARBOXYLIC ACIDS EPIS S.A. (CH) 1988-04-21 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 (1 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-20110004013-A1 METHOD FOR PRODUCING DIHYDROXYBENZENE DERIVATIVE UBE2B, UBE2G2, TUBB2B TBXAS1 2114/4885LMNA 3340/4885GPR84 933/4885

“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.