SCHEMBL247751

SCHEMBL247751

C=C(C)C(=O)OCCC1CCO1

nearest known ligand 0.54

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.54
THRB P10828 1/20 0.44
TSHR P16473 4/20 0.43
EPHX1 P07099 2/20 0.35
POLB P06746 2/20 0.34
APEX1 P27695 1/20 0.34
HTT P42858 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
LMNA P02545 1/20 0.33
CYP3A4 P08684 2/20 0.32
TP53 P04637 1/20 0.32
PDK1 Q15118 1/20 0.31
KMT2A Q03164 1/20 0.30
CYP2D6 P10635 1/20 0.30
CYP2C19 P33261 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
SCHEMBL21714157 0.92 ALDH1A1 (0.50) ALDH1A1THRBTSHRPOLBHTT
SCHEMBL3953476 0.90 ALDH1A1 (0.51) ALDH1A1THRBTSHREPHX1POLB
SCHEMBL3951272 0.89 TSHR (0.51) ALDH1A1THRBTSHREPHX1POLB
SCHEMBL352927 0.86 ALDH1A1 (0.68) ALDH1A1THRBTSHREPHX1POLB
SCHEMBL20505422 0.86 ALDH1A1 (0.68) ALDH1A1THRBTSHREPHX1POLB
SCHEMBL28207406 0.83 ALDH1A1 (0.47) ALDH1A1THRBTSHRPOLBAPEX1
SCHEMBL244871 0.82 ALDH1A1 (0.73) ALDH1A1THRBTSHRPOLBLMNA
SCHEMBL5478637 0.82 ALDH1A1 (0.46) ALDH1A1THRBTSHRPOLBAPEX1
SCHEMBL27706838 0.81 ALDH1A1 (0.45) ALDH1A1THRBTSHRPOLBAPEX1
SCHEMBL247377 0.80 ALDH1A1 (0.33) ALDH1A1EPHX1POLBLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023189203-A1 COMPOSITION, FILM, AND DISPLAY DEVICE 住友化学株式会社 2023-10-05 WO disclosed
WO-2023189205-A1 COMPOSITION, FILM, AND DISPLAY DEVICE 住友化学株式会社 2023-10-05 WO disclosed
WO-2023189204-A1 COMPOSITION, FILM, AND DISPLAY DEVICE 住友化学株式会社 2023-10-05 WO disclosed
WO-2022044822-A1 RESIN COMPOSITION, RESIN FILM, AND DISPLAY DEVICE 住友化学株式会社 2022-03-03 WO disclosed
WO-2022044824-A1 LAYERED BODY AND DISPLAY DEVICE 住友化学株式会社 2022-03-03 WO disclosed
WO-2021132332-A1 COMPOSITION AND DISPLAY DEVICE 住友化学株式会社 2021-07-01 WO disclosed
US-8323536-B2 Near-infrared absorbing dye, near-infrared absorptive film-forming composition, and near-infrared absorptive film SHIN-ETSU CHEMICAL CO., LTD. (JP) 2012-12-04 US disclosed
US-20120119171-A1 NEAR-INFRARED ABSORBING DYE, NEAR-INFRARED ABSORPTIVE FILM-FORMING COMPOSITION, AND NEAR-INFRARED ABSORPTIVE FILM SHIN-ETSU CHEMICAL CO., LTD. (JP) 2012-05-17 US disclosed
US-20120002138-A1 Pattern forming ink composition, light guide plate, light emitting unit and liquid crystal display element having the light emitting unit CHI-MEI CORPORATION 2012-01-05 US disclosed
US-20110281040-A1 LIQUID CRYSTAL DISPLAY ELEMENT, POSITIVE TYPE RADIATION SENSITIVE COMPOSITION, INTERLAYER INSULATING FILM FOR LIQUID CRYSTAL DISPLAY ELEMENT, AND FORMATION METHOD THEREOF JSR CORPORATION (JP) 2011-11-17 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-20120119171-A1 NEAR-INFRARED ABSORBING DYE, NEAR-INFRARED ABSORPTIVE FILM-FORMING COMPOSITION, AND NEAR-INFRARED ABSORPTIVE FILM SLCO2A1, SLC39A3, SLCO2B1 ALDH1A1 1150/4885THRB 2257/4885TSHR 966/4885

“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.