SCHEMBL21082018

SCHEMBL21082018

CC(C)(C)CC(=O)C(=[N+]=[N-])C(=O)O

nearest known ligand 0.32

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HMGCR P04035 1/20 0.31
CHRM1 P11229 1/20 0.31
TBXA2R P21731 1/20 0.31
ADRA1A P35348 1/20 0.31
CYP2D6 P10635 1/20 0.30
TSHR P16473 1/20 0.30
CYP2C19 P33261 1/20 0.30
HIF1A Q16665 1/20 0.30

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
SCHEMBL27549933 0.75 FFAR3 (0.36)
SCHEMBL3697055 0.73 HMGCR (0.41) HMGCRCHRM1TBXA2RADRA1ACYP2D6
SCHEMBL10968402 0.72 OR51E2 (0.48)
SCHEMBL8874275 0.71 HMGCR (0.39) HMGCRCHRM1TBXA2RADRA1ACYP2D6
SCHEMBL15109970 0.70 LDHA (0.38) TSHR
SCHEMBL14914212 0.69 HMGCR (0.40) HMGCRCHRM1TBXA2RADRA1ACYP2D6
SCHEMBL8406590 0.69
SCHEMBL8316489 0.69 HMGCR (0.38) HMGCRCHRM1TBXA2RADRA1ACYP2D6
T-Butylacetic Acid SCHEMBL10950588 0.67 HMGCR (0.61) HMGCRCHRM1TBXA2RADRA1ACYP2D6
T-Butylacetic Acid SCHEMBL71379 0.67

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4005794-B1 MEDICAL INSTRUMENT AND METHOD FOR MANUFACTURING SAME TERUMO CORP (JP) 2024-07-10 EP disclosed
EP-3747479-B1 MEDICAL INSTRUMENT TERUMO CORP (JP) 2024-05-29 EP disclosed
US-20240076796-A1 PULSE METHOD FOR THE ELECTRODEPOSITION OF CONDUCTIVE POLYMER Heraeus Medevio GmbH & Co. KG (DE) 2024-03-07 US disclosed
US-11872326-B2 Medical instrument TERUMO KABUSHIKI KAISHA (JP) 2024-01-16 US disclosed
EP-4018975-A1 MEDICAL INSTRUMENT AND METHOD FOR MANUFACTURING SAME TERUMO Kabushiki Kaisha (JP) 2022-06-29 EP disclosed
US-20220176022-A1 MEDICAL DEVICE AND METHOD FOR MANUFACTURING SAME TERUMO KABUSHIKI KAISHA (JP) 2022-06-09 US disclosed
US-20220177618-A1 MEDICAL DEVICE AND METHOD FOR MANUFACTURING SAME TERUMO KABUSHIKI KAISHA (JP) 2022-06-09 US disclosed
US-20220168476-A1 MEDICAL DEVICE AND METHOD FOR MANUFACTURING SAME TERUMO KABUSHIKI KAISHA (JP) 2022-06-02 US disclosed
US-20220168479-A1 MEDICAL DEVICE AND METHOD FOR MANUFACTURING SAME TERUMO KABUSHIKI KAISHA (JP) 2022-06-02 US disclosed
US-20220168475-A1 MEDICAL DEVICE AND METHOD FOR MANUFACTURING SAME TERUMO KABUSHIKI KAISHA (JP) 2022-06-02 US disclosed
EP-4005794-A1 MEDICAL INSTRUMENT AND METHOD FOR MANUFACTURING SAME TERUMO Kabushiki Kaisha (JP) 2022-06-01 EP disclosed
EP-4006069-A1 MEDICAL INSTRUMENT AND PRODUCTION METHOD THEREFOR TERUMO Kabushiki Kaisha (JP) 2022-06-01 EP disclosed
EP-4006068-A1 MEDICAL INSTRUMENT AND MANUFACTURING METHOD THEREFOR TERUMO Kabushiki Kaisha (JP) 2022-06-01 EP disclosed
EP-4006070-A1 MEDICAL INSTRUMENT AND METHOD FOR MANUFACTURING SAME TERUMO Kabushiki Kaisha (JP) 2022-06-01 EP disclosed
EP-3505543-B1 HYDROPHILIC COPOLYMER AND MEDICAL DEVICE TERUMO CORP (JP) 2021-07-28 EP disclosed
US-20210102019-A1 HYDROPHILIC COPOLYMER AND MEDICAL DEVICE TERUMO KABUSHIKI KAISHA (JP) 2021-04-08 US disclosed
EP-3747479-A1 MEDICAL INSTRUMENT Terumo Kabushiki Kaisha (JP) 2020-12-09 EP disclosed
US-20200376171-A1 MEDICAL INSTRUMENT TERUMO KABUSHIKI KAISHA (JP) 2020-12-03 US disclosed
WO-2019163764-A1 MEDICAL INSTRUMENT テルモ株式会社 2019-08-29 WO disclosed
EP-3505543-A1 HYDROPHILIC COPOLYMER AND MEDICAL DEVICE Terumo Kabushiki Kaisha (JP) 2019-07-03 EP disclosed