SCHEMBL3101130

SCHEMBL3101130

CC(CO)(CO)CO.CCC(S)CC(=O)O.CCC(S)CC(=O)O.CCC(S)CC(=O)O

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SLC22A6 Q4U2R8 1/20 0.32
MME P08473 1/20 0.32
ACE P12821 1/20 0.32
CPA1 P15085 1/20 0.32
ACE2 Q9BYF1 1/20 0.32
TDP1 Q9NUW8 1/20 0.31
FFAR3 O14843 1/20 0.31
PGD P52209 1/20 0.31
GPR84 Q9NQS5 4/20 0.31
SMN1; SMN2 Q16637 1/20 0.30
HMGCR P04035 1/20 0.30
CHRM1 P11229 1/20 0.30
TBXA2R P21731 1/20 0.30
ADRA1A P35348 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
SCHEMBL869462 0.88 GPR84 (0.34) SLC22A6MMEACECPA1ACE2
SCHEMBL868663 0.88 GPR84 (0.34) SLC22A6MMEACECPA1ACE2
SCHEMBL867994 0.88 GPR84 (0.34) SLC22A6MMEACECPA1ACE2
SCHEMBL1171039 0.88 GPR84 (0.34) SLC22A6MMEACECPA1ACE2
SCHEMBL869031 0.87
Ethylene Glycol SCHEMBL869611 0.85 SLC22A6 (0.36) SLC22A6MMEACECPA1ACE2
Hydrochloric Acid SCHEMBL7710602 0.84
SCHEMBL869805 0.84 GPR84 (0.32) SLC22A6MMEACECPA1ACE2
SCHEMBL869290 0.84 GPR84 (0.32) SLC22A6MMEACECPA1ACE2
1,3-Propanediol SCHEMBL16857566 0.81 CAMK2A (0.37) SLC22A6MMEACECPA1ACE2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9709952-B2 Photosensitive composition for volume hologram recording, photosensitive substrate for volume hologram recording, and volume hologram recorded medium DAI NIPPON PRINTING CO., LTD. (JP) 2017-07-18 US disclosed
EP-2889700-B1 PHOTOSENSITIVE COMPOSITION FOR VOLUME HOLOGRAM RECORDING, PHOTOSENSITIVE SUBSTRATE FOR VOLUME HOLOGRAM RECORDING, AND VOLUME HOLOGRAM-RECORDED OBJECT DAINIPPON PRINTING CO LTD (JP) 2017-01-25 EP disclosed
US-20150212487-A1 PHOTOSENSITIVE COMPOSITION FOR VOLUME HOLOGRAM RECORDING, PHOTOSENSITIVE SUBSTRATE FOR VOLUME HOLOGRAM RECORDING, AND VOLUME HOLOGRAM RECORDED MEDIUM DAI NIPPON PRINTING CO., LTD. 2015-07-30 US disclosed
EP-2889700-A1 PHOTOSENSITIVE COMPOSITION FOR VOLUME HOLOGRAM RECORDING, PHOTOSENSITIVE SUBSTRATE FOR VOLUME HOLOGRAM RECORDING, AND VOLUME HOLOGRAM-RECORDED OBJECT Dai Nippon Printing Co., Ltd. (JP) 2015-07-01 EP disclosed
US-8283095-B2 Thiourethane compound and photosensitive resin composition SHOWA DENKO K.K. (JP) 2012-10-09 US disclosed
US-20100233596-A1 THIOURETHANE COMPOUND AND PHOTOSENSITIVE RESIN COMPOSITION SHOWA DENKO K.K. (JP) 2010-09-16 US disclosed
EP-2055726-A1 THIOURETHANE COMPOUND AND PHOTOSENSITIVE RESIN COMPOSITION Showa Denko K.K. (JP) 2009-05-06 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-20100233596-A1 THIOURETHANE COMPOUND AND PHOTOSENSITIVE RESIN COMPOSITION RCOR3, CBR3, TAS2R3 SLC22A6 3369/4885MME 4643/4885ACE 4708/4885

“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.