SCHEMBL666918

SCHEMBL666918

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

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.50
HCAR2 Q8TDS4 1/20 0.39
ADRA1A P35348 1/20 0.39
PDE4D Q08499 1/20 0.39
GAA P10253 2/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
PTP4A3 O75365 1/20 0.33
PTP4A2 Q12974 1/20 0.33
PTP4A1 Q93096 1/20 0.33
CA12 O43570 5/20 0.31
CA1 P00915 5/20 0.31
CA2 P00918 5/20 0.31
CA9 Q16790 5/20 0.31
CA7 P43166 4/20 0.31
CA14 Q9ULX7 4/20 0.31
LMNA P02545 2/20 0.31
MAPT P10636 2/20 0.31
ALDH1A1 P00352 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
MEN1 O00255 1/20 0.31

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
SCHEMBL13613127 1.00 TSHR (0.50) TSHRHCAR2ADRA1APDE4DGAA
SCHEMBL1532594 1.00 TSHR (0.50) TSHRHCAR2ADRA1APDE4DGAA
SCHEMBL3338061 0.97 TSHR (0.48) TSHRHCAR2ADRA1APDE4DGAA
SCHEMBL448478 0.97 TSHR (0.48) TSHRHCAR2ADRA1APDE4DGAA
SCHEMBL10948804 0.84 TSHR (0.38) TSHRHCAR2MAPT
SCHEMBL2598286 0.82 TSHR (0.48) TSHRHCAR2ADRA1APDE4DGAA
SCHEMBL10687993 0.82 TSHR (0.48) TSHRHCAR2ADRA1APDE4DGAA
SCHEMBL17472929 0.82 TSHR (0.36) TSHR
SCHEMBL173350 0.82 TSHR (0.36) TSHR
SCHEMBL173352 0.82 TSHR (0.36) TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009131692-A1 SUBSTRATES FOR DELIVERY OF PHYSIOLOGICALLY ACTIVE AGENTS THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ALABAMA (US) 2009-10-29 WO claimed
US-5116415-A Hydrophilic Hydrogel AQS, INC. (US) 1992-05-26 US claimed
US-20250052763-A1 COMPOSITIONS AND METHODS FOR IDENTIFYING LIGANDS OF ODORANT RECEPTORS DUKE UNIVERSITY 2025-02-13 US disclosed
US-20240277012-A1 DUPLICATE BEVERAGE WANG JIE (US) 2024-08-22 US disclosed
US-11872292-B2 Cationically and radiation curable composition 3M INNOVATIVE PROPERTIES COMPANY (US) 2024-01-16 US disclosed
EP-3416729-B1 PRO-FRAGRANCE COMPOSITION AQDOT LTD (GB) 2023-09-20 EP disclosed
WO-2023114251-A1 COMPOSITIONS AND METHODS FOR IDENTIFYING LIGANDS OF ODORANT RECEPTORS DUKE UNIVERSITY (US) 2023-06-22 WO disclosed
CN-108601958-B Pro-fragrance compositions 爱客多有限公司 2022-06-17 CN disclosed
EP-3515396-B1 CATIONICALLY AND RADIATION CURABLE COMPOSITION 3M INNOVATIVE PROPERTIES CO (US) 2022-01-05 EP disclosed
CN-108473484-B Compounds useful as TRPM8 modulators 弗门尼舍公司 2021-06-29 CN disclosed
EP-3533436-B1 COMPOSITIONS COMPRISING MENTHOL, ISOBORNYL BUTYRATE AND APRITONE PROCTER & GAMBLE (US) 2020-12-23 EP disclosed
US-20040020367-A1 ANTI-PATHOGENIC AIR FILTRATION MEDIA AND AIR HANDLING DEVICES HAVING PROTECTIVE CAPABILITIES AGAINST INFECTIOUS AIRBORNE MICROORGANISMS INNOVATIVE CONSTRUCTION AND BUILDING MATERIALS, LLC 2004-02-05 US disclosed
EP-1365915-A1 POLYMER GEL CONTACT MASKS AND METHODS AND MOLDS FOR MAKING SAME Surface Logix, Inc. (US) 2003-12-03 EP disclosed
EP-1352907-A1 PROCESSES FOR PREPARING CALANOLIDE A AND INTERMEDIATES THEREOF KURARAY CO., LTD. (JP) 2003-10-15 EP disclosed
WO-2003039713-A1 ANTI-PATHOGENIC AIR FILTRATION MEDIA AND AIR HANDLING DEVICES HAVING PROTECTIVE CAPABILITIES AGAINST INFECTIOUS AIRBORNE MICROORGANISMS INNOVATIVE CONSTRUCTION AND BUILDING MATERIALS, LLC (US) 2003-05-15 WO disclosed
WO-2002036342-A1 POLYMER GEL CONTACT MASKS AND METHODS AND MOLDS FOR MAKING SAME SURFACE LOGIX, INC. (US) 2002-05-10 WO disclosed
US-6270348-B1 Chopped fiber reinforced dental material PETERSEN RICHARD (US) 2001-08-07 US disclosed
US-5800897-A Air freshener composition containing a fiber pad EASTMAN CHEMICAL COMPANY (US) 1998-09-01 US disclosed
WO-1997026926-A1 AIR FRESHENER COMPOSITION CONTAINING A FIBER PAD EASTMAN CHEMICAL COMPANY (US) 1997-07-31 WO disclosed
US-5116415-A Hydrophilic Hydrogel AQS, INC. (US) 1992-05-26 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-11872292-B2 Cationically and radiation curable composition RAD51, SMARCA1, SMARCA4 TSHR 4421/4885HCAR2 2486/4885ADRA1A 2312/4885

“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.