SCHEMBL8414890

SCHEMBL8414890

CC(CC(=O)OCC1CO1)CC(C)(C)C

nearest known ligand 0.42

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.42
TP53 P04637 1/20 0.39
CYP3A4 P08684 1/20 0.39
MGLL Q99685 2/20 0.38
TSHR P16473 1/20 0.36
MAPK1 P28482 1/20 0.36

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
SCHEMBL25244602 0.87 ALDH1A1 (0.40) ALDH1A1TP53CYP3A4MGLLTSHR
SCHEMBL28096991 0.81 ALDH1A1 (0.45) ALDH1A1TP53CYP3A4MGLL
SCHEMBL14256247 0.80 ALDH1A1 (0.50) ALDH1A1TP53CYP3A4MGLL
SCHEMBL13941998 0.79 ALDH1A1 (0.46) ALDH1A1TP53CYP3A4MGLLTSHR
SCHEMBL13050770 0.77 MMP1 (0.31)
SCHEMBL9960265 0.77 ALDH1A1 (0.44) ALDH1A1TP53CYP3A4MGLL
SCHEMBL14881212 0.76 ALDH1A1 (0.50) ALDH1A1TP53CYP3A4MGLLTSHR
SCHEMBL18754364 0.76 ALDH1A1 (0.41) ALDH1A1TP53CYP3A4MGLLTSHR
SCHEMBL23203780 0.76 ALDH1A1 (0.38) ALDH1A1TP53CYP3A4TSHRMAPK1
SCHEMBL27596900 0.76 ALDH1A1 (0.46) ALDH1A1TP53CYP3A4MGLL

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 22 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2551333-B1 LUBRICATING OIL COMPOSITION FOR CHILLER IDEMITSU KOSAN CO (JP) 2020-12-16 EP disclosed
EP-2551334-B1 LUBRICATING OIL COMPOSITION FOR CHILLER IDEMITSU KOSAN CO (JP) 2020-11-11 EP disclosed
US-10774252-B2 Lubricant oil composition for compression refrigerator IDEMITSU KOSAN CO., LTD. (JP) 2020-09-15 US disclosed
EP-2623583-B1 COMPOSITION FOR COMPRESSION REFRIGERATOR IDEMITSU KOSAN CO (JP) 2018-04-04 EP disclosed
US-9546334-B2 Refrigerating machine oil, and working fluid composition for refrigerating machine which is produced using same KH NEOCHEM CO., LTD. (JP) 2017-01-17 US disclosed
US-20160168500-A1 Refrigerating Machine Oil, and Working Fluid Composition for Refrigerating Machine Which is Produced Using Same KH NEOCHEM CO., LTD. (JP) 2016-06-16 US disclosed
US-20160053154-A1 LUBRICANT OIL COMPOSITION FOR COMPRESSION REFRIGERATOR IDEMITSU KOSAN CO., LTD. (JP) 2016-02-25 US disclosed
CN-102791838-B Lubricating oil composition for refrigerator IDEMITSU KOSAN CO.,LTD. (JP) 2016-01-06 CN disclosed
CN-102791840-B Lubricating oil composition for refrigerator IDEMITSU KOSAN CO.,LTD. (JP) 2016-01-06 CN disclosed
US-9212303-B2 Lubricating oil composition for chiller IDEMITSU KOSAN CO., LTD. (JP) 2015-12-15 US disclosed
US-20130274163-A1 LUBRICANT OIL COMPOSITION FOR COMPRESSION REFRIGERATOR IDEMITSU KOSAN CO., LTD. (JP) 2013-10-17 US disclosed
EP-2623583-A1 LUBRICANT OIL COMPOSITION FOR COMPRESSION REFRIGERATOR Idemitsu Kosan Co., Ltd. (JP) 2013-08-07 EP disclosed
EP-2551334-A1 LUBRICATING OIL COMPOSITION FOR CHILLER Idemitsu Kosan Co., Ltd. (JP) 2013-01-30 EP disclosed
EP-2551333-A1 LUBRICATING OIL COMPOSITION FOR CHILLER Idemitsu Kosan Co., Ltd. (JP) 2013-01-30 EP disclosed
US-20130012420-A1 LUBRICATING OIL COMPOSITION FOR CHILLER IDEMITSU KOSAN CO., LTD. (JP) 2013-01-10 US disclosed
US-20130012419-A1 LUBRICATING OIL COMPOSITION FOR CHILLER IDEMITSU KOSAN CO., LTD. (JP) 2013-01-10 US disclosed
CN-101663381-A Lubricating oil composition for refrigerator IDEMITSU KOSAN CO 2010-03-03 CN disclosed
EP-0586705-B1 LUBRICATING OIL FOR REFRIGERATOR TONEN CORP (JP) 1999-08-25 EP disclosed
US-5798054-A A FUMARIC DIETHYL COPOLYMER BLENDS COMPRISING A FATTY ESTER AND A POLYETHER; LUBRICANTS IN REFRIGERATOR, FREEZER, CAR AIR CONDITIONERS; HEAT RESISTANCE, CHEMICAL RESISTANCE, HIGH VISCOSITY EXXON CHEMICAL PATENTS INC. (US) 1998-08-25 US disclosed
EP-0586705-A1 LUBRICATING OIL FOR REFRIGERATOR Tonen Corporation (JP) 1994-03-16 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-20160168500-A1 Refrigerating Machine Oil, and Working Fluid Composition for Refrigerating Machine Which is Produced Using Same DAGLA, ELOVL1, THPO ALDH1A1 2504/4885TP53 3741/4885CYP3A4 403/4885

“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.