SCHEMBL18179612

SCHEMBL18179612

CCOC(=O)C1CCC(C(=O)OCC)O1

nearest known ligand 0.58

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PPM1B O75688 1/20 0.52
PTPN1 P18031 1/20 0.52
PPP1CC P36873 1/20 0.52
ALDH1A1 P00352 4/20 0.46
SOAT1 P35610 1/20 0.42
MAPT P10636 2/20 0.42
TSHR P16473 1/20 0.42
CYP4F2 P78329 1/20 0.41
CYP4A11 Q02928 1/20 0.41
LMNA P02545 1/20 0.39
HSD17B10 Q99714 1/20 0.39
ALOX15 P16050 1/20 0.37
MGAM O43451 1/20 0.37
GAA P10253 1/20 0.37
SI P14410 1/20 0.37
MGAM2 Q2M2H8 1/20 0.37

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
SCHEMBL12899466 0.88 PPM1B (0.46) PPM1BPTPN1PPP1CCALDH1A1SOAT1
SCHEMBL11471218 0.88 PPM1B (0.46) PPM1BPTPN1PPP1CCALDH1A1SOAT1
SCHEMBL8571273 0.88 PPM1B (0.46) PPM1BPTPN1PPP1CCALDH1A1SOAT1
SCHEMBL8573405 0.88 PPM1B (0.46) PPM1BPTPN1PPP1CCALDH1A1SOAT1
SCHEMBL11471217 0.88 PPM1B (0.46) PPM1BPTPN1PPP1CCALDH1A1SOAT1
SCHEMBL23797762 0.88 PPM1B (0.46) PPM1BPTPN1PPP1CCALDH1A1SOAT1
SCHEMBL11470419 0.85 PPM1B (0.44) PPM1BPTPN1PPP1CCALDH1A1SOAT1
SCHEMBL11471214 0.85 PPM1B (0.44) PPM1BPTPN1PPP1CCALDH1A1SOAT1
SCHEMBL11471212 0.85 PPM1B (0.44) PPM1BPTPN1PPP1CCALDH1A1SOAT1
SCHEMBL11470420 0.85 PPM1B (0.44) PPM1BPTPN1PPP1CCALDH1A1SOAT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111606804-B Method for preparing adipate derivatives 中国石油化工股份有限公司 2023-04-11 CN disclosed
CN-111606804-A Method for preparing adipate derivatives 中国石油化工股份有限公司 2020-09-01 CN disclosed
CN-107004768-B Organic semiconductor composition containing a liquid medium 巴斯夫欧洲公司 2020-08-21 CN disclosed
US-20170250347-A1 ORGANIC SEMICONDUCTOR COMPOSITION COMPRISING A LIQUID MEDIUM BASF SE (DE) 2017-08-31 US disclosed
US-20160312004-A1 SOFTENER COMPOSITION WHICH CONTAINS TETRAHYDROFURAN DERIVATIVES AND 1,2-CYCLOHEXANE DICARBOXYLIC ACID ESTERS BASF SE (DE) 2016-10-27 US 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-20170250347-A1 ORGANIC SEMICONDUCTOR COMPOSITION COMPRISING A LIQUID MEDIUM CRY1, NEFM, OR10J3 PPM1B 375/4885PTPN1 122/4885PPP1CC 179/4885

“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.