SCHEMBL6300032

SCHEMBL6300032

CCC(=O)OC(C)OC(=O)CC

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 2/20 0.41
MEN1 O00255 1/20 0.41
RECQL P46063 1/20 0.41
KMT2A Q03164 1/20 0.41
ALDH1A1 P00352 3/20 0.39
LMNA P02545 2/20 0.38
NAAA Q02083 1/20 0.36
TDP1 Q9NUW8 2/20 0.35
FFAR3 O14843 1/20 0.35
TSHR P16473 1/20 0.35
ALOX15 P16050 1/20 0.34
HIF1A Q16665 2/20 0.33
MGAM O43451 1/20 0.33
GAA P10253 1/20 0.33
SI P14410 1/20 0.33
MGAM2 Q2M2H8 1/20 0.33
ESR1 P03372 1/20 0.33
MMP1 P03956 1/20 0.33
MMP2 P08253 1/20 0.33
MMP3 P08254 1/20 0.33

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
SCHEMBL15635387 0.92 LMNA (0.43) CYP2C19MEN1RECQLKMT2AALDH1A1
SCHEMBL5987683 0.90 TSHR (0.46) CYP2C19MEN1RECQLKMT2AALDH1A1
SCHEMBL5987635 0.90 TSHR (0.46) CYP2C19MEN1RECQLKMT2AALDH1A1
SCHEMBL7603104 0.90 TSHR (0.46) CYP2C19MEN1RECQLKMT2AALDH1A1
SCHEMBL27743278 0.89 CYP2C19 (0.38) CYP2C19MEN1RECQLKMT2AALDH1A1
SCHEMBL10293909 0.88 CYP2C19 (0.35) CYP2C19MEN1RECQLKMT2AALDH1A1
SCHEMBL13647279 0.88 MMP1 (0.50) CYP2C19MEN1RECQLKMT2AALDH1A1
SCHEMBL18331644 0.88 CYP2C19 (0.35) CYP2C19MEN1RECQLKMT2AALDH1A1
SCHEMBL3836321 0.88 LMNA (0.55) MEN1KMT2AALDH1A1LMNATSHR
SCHEMBL26669062 0.88 MEN1 (0.35) CYP2C19MEN1RECQLKMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115282913-A Reaction system and method for preparing methyl propionate 中国海洋石油集团有限公司 2022-11-04 CN disclosed
US-20080318922-A1 Bicyclic Pyrrole Derivatives DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2008-12-25 US disclosed
US-6902785-B2 Laminar structure DENOVUS LLC (US) 2005-06-07 US disclosed
US-6638590-B2 Tacky mastic in contact with ultraviolet light and moisture barrier; for protection of wood, metal, concrete, cement DENOVUS LLC 2003-10-28 US disclosed
EP-0219906-B1 PROCESS FOR THE PREPARATION OF ALKYLIDENE DIESTERS SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1990-06-06 EP disclosed
US-4810821-A CATALYTIC CARBONYLATION, HYDROGENATION, ESTERIFICATION MONSANTO COMPANY (US) 1989-03-07 US disclosed
EP-0219906-A2 Process for the preparation of alkylidene diesters SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1987-04-29 EP disclosed
EP-0077116-B1 PREPARATION OF ALKYLIDENE DIESTERS MONSANTO COMPANY (US) 1984-09-12 EP disclosed
EP-0077116-A1 Preparation of alkylidene diesters MONSANTO COMPANY (US) 1983-04-20 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-20080318922-A1 Bicyclic Pyrrole Derivatives DPP4, DPP7, DPP3 CYP2C19 41/4885MEN1 3498/4885RECQL 2068/4885

“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.