SCHEMBL6413786

SCHEMBL6413786

CC1(C)C(COCc2ccc(-c3ccccc3)cc2)C1C(=O)O

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 2/20 0.42
IDO1 P14902 2/20 0.39
AGXT P21549 2/20 0.39
ABCC4 O15439 1/20 0.39
LMNA P02545 1/20 0.39
GAA P10253 1/20 0.39
TSHR P16473 1/20 0.39
PTGS1 P23219 1/20 0.39
HTT P42858 1/20 0.39
FFAR1 O14842 2/20 0.39
EPHX1 P07099 1/20 0.39
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
FFAR4 Q5NUL3 2/20 0.38

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
SCHEMBL6521285 0.91 TSHR (0.42) LMNATSHR
SCHEMBL11312924 0.91 TSHR (0.42) LMNATSHR
SCHEMBL6521289 0.91 TSHR (0.42) LMNATSHR
SCHEMBL3690693 0.91 TSHR (0.42) LMNATSHR
SCHEMBL1154270 0.91 TSHR (0.42) LMNATSHR
SCHEMBL6406988 0.88 NAAA (0.40) NAAAHTTEPHX1NPC1RAB9A
SCHEMBL6406994 0.86 ATM (0.42) NAAATSHREPHX1NPC1RAB9A
SCHEMBL6406124 0.85 PPARA (0.41) NAAA
SCHEMBL6406010 0.83 MMP1 (0.45) IDO1AGXTHTTFFAR1NPC1
SCHEMBL6414745 0.81 EPHX1 (0.44) NAAALMNAEPHX1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050288526-A1 Process for production of 2-(hydroxymethyl)cyclo-propanecarboxylic acids SUMITOMO CHEMICAL COMPAY LIMTED (JP) 2005-12-29 US disclosed
CN-1681767-A Method for manufacturing 2-(hydroxymethyl) cyclopropane carboxylic acid compound SUMITOMO CHEMICAL CO (JP) 2005-10-12 CN disclosed
EP-1538141-A1 PROCESS FOR PRODUCTION OF 2-(HYDROXYMETHYL)CYCLO- PROPANECARBOXYLIC ACIDS Sumitomo Chemical Company, Limited (JP) 2005-06-08 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 (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-20050288526-A1 Process for production of 2-(hydroxymethyl)cyclo-propanecarboxylic acids GRHPR, PCCA, C5 NAAA 1503/4885IDO1 270/4885AGXT 433/4885

“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.