SCHEMBL3868378

SCHEMBL3868378

CCCCCCC(C(=O)O)n1cccc1

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 7/20 0.48
FFAR1 O14842 2/20 0.48
MAPT P10636 1/20 0.47
LCK P06239 1/20 0.47
PPARD Q03181 1/20 0.47
ZDHHC20 Q5W0Z9 1/20 0.47
ZDHHC2 Q9UIJ5 1/20 0.47
NPSR1 Q6W5P4 1/20 0.46
HSD17B10 Q99714 1/20 0.46
ACE2 Q9BYF1 1/20 0.44
AGTR1 P30556 1/20 0.42
AGTR2 P50052 1/20 0.42
GRIK1 P39086 2/20 0.41
GRIK2 Q13002 2/20 0.41
FFAR4 Q5NUL3 1/20 0.41
PPARG P37231 1/20 0.40
SLC1A2 P43004 1/20 0.39
SLC1A1 P43005 1/20 0.39

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
SCHEMBL18258631 1.00 GPR84 (0.48) GPR84FFAR1MAPTLCKPPARD
SCHEMBL5524539 0.98 NPSR1 (0.47) GPR84FFAR1MAPTLCKPPARD
SCHEMBL18258587 0.93 NPSR1 (0.49) GPR84FFAR1MAPTLCKPPARD
SCHEMBL18258589 0.93 NPSR1 (0.49) GPR84FFAR1MAPTLCKPPARD
SCHEMBL18258632 0.85 NPSR1 (0.52) MAPTNPSR1HSD17B10PPARG
SCHEMBL5512388 0.85 NPSR1 (0.52) MAPTNPSR1HSD17B10PPARG
SCHEMBL11536801 0.82 HSD17B10 (0.46) FFAR1MAPTNPSR1HSD17B10FFAR4
SCHEMBL11534759 0.82 HSD17B10 (0.46) FFAR1MAPTNPSR1HSD17B10FFAR4
SCHEMBL11536585 0.82 HSD17B10 (0.46) FFAR1MAPTNPSR1HSD17B10FFAR4
SCHEMBL11537659 0.82 HSD17B10 (0.46) FFAR1MAPTNPSR1HSD17B10FFAR4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190069527-A1 MOUSE MODEL OF RETINAL DEGENERATION CLEVELAND CLINIC FOUNDATION 2019-03-07 US disclosed
US-20180160660-A1 MOUSE MODEL OF RETINAL DEGENERATION CLEVELAND CLINIC FOUNDATION 2018-06-14 US disclosed
US-9796640-B2 Method for producing optically active carboxylic acid ester TOKYO UNIVERSITY OF SCIENCE FOUNDATION (JP) 2017-10-24 US disclosed
US-20170105394-A1 MOUSE MODEL OF RETINAL DEGENERATION CLEVELAND CLINIC FOUNDATION 2017-04-20 US disclosed
US-20170008820-A1 METHOD FOR PRODUCING OPTICALLY ACTIVE CARBOXYLIC ACID ESTER TOKYO UNIVERSITY OF SCIENCE FOUNDATION (JP) 2017-01-12 US disclosed
EP-3098217-A1 METHOD FOR PRODUCING OPTICALLY ACTIVE CARBOXYLIC ACID ESTER Tokyo University of Science Foundation (JP) 2016-11-30 EP disclosed
US-20160242397-A1 MOUSE MODEL OF RETINAL DEGENERATION NATIONAL INSTITUTES OF HEALTH - DIRECTOR DEITR 2016-08-25 US disclosed
US-20140182004-A1 MOUSE MODEL OF RETINAL DEGENERATION THE CLEVELAND CLINIC FOUNDATION (US) 2014-06-26 US disclosed
US-8664470-B2 Mouse model of retinal degeneration THE CLEVELAND CLINIC FOUNDATION (US) 2014-03-04 US disclosed
US-20090155243-A1 NON-HUMAN MODEL OF AUTOIMMUNE DISEASE THE CLEVELAND CLINIC FOUNDATION (US) 2009-06-18 US disclosed
WO-2008089487-A2 CARBOXYETHYLPYRROLE COMPOUNDS AND METHODS OF THEIR PRODUCTION THE CLEVELAND CLINIC FOUNDATION (US) 2008-07-24 WO disclosed
WO-2008089485-A2 CARBOXYETHYLPYRROLE COMPOUNDS AND METHODS OF THEIR PRODUCTION THE CLEVELAND CLINIC FOUNDATION (US) 2008-07-24 WO disclosed
WO-2007127151-A2 NON-HUMAN MODEL OF AUTOIMMUNE DISEASE THE CLEVELAND CLINIC FOUNDATION (US) 2007-11-08 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-20170008820-A1 METHOD FOR PRODUCING OPTICALLY ACTIVE CARBOXYLIC ACID ESTER ADH1A, ALDH1A2, ADH1C GPR84 948/4885FFAR1 68/4885MAPT 2920/4885

“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.