SCHEMBL18179723

SCHEMBL18179723

CC(C)CC(=O)OCC(COC(=O)CC(C)S)(COC(=O)CC(C)S)COC(=O)CC(C)S

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 1/20 0.36
MMP2 P08253 1/20 0.36
MMP3 P08254 1/20 0.36
MMP9 P14780 1/20 0.36
MMP13 P45452 1/20 0.36
PRKCA P17252 2/20 0.33
ALDH1A1 P00352 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
CA2 P00918 1/20 0.31
PRKD3 O94806 1/20 0.31
PRKCG P05129 1/20 0.31
PRKCB P05771 1/20 0.31
PRKCH P24723 1/20 0.31
PRKCI P41743 1/20 0.31
PRKCE Q02156 1/20 0.31
PRKCQ Q04759 1/20 0.31
PRKCZ Q05513 1/20 0.31
PRKCD Q05655 1/20 0.31
PRKD1 Q15139 1/20 0.31
GLA P06280 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
SCHEMBL98537 0.94 MAPK1 (0.31) PRKCA
SCHEMBL25709485 0.91 MMP1 (0.33) MMP1MMP2MMP3MMP9MMP13
SCHEMBL8216917 0.90 MMP1 (0.42) MMP1MMP2MMP3MMP9MMP13
SCHEMBL869642 0.89 ALDH1A1 (0.37) PRKCAALDH1A1
SCHEMBL25709316 0.89 ALDH1A1 (0.37) PRKCAALDH1A1
SCHEMBL868170 0.89
SCHEMBL869409 0.89 ALDH1A1 (0.41) PRKCAALDH1A1
SCHEMBL25011702 0.87
SCHEMBL13129066 0.87
SCHEMBL868957 0.86 ALDH1A1 (0.37) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230202976-A1 METHOD FOR PRODUCING THIOL COMPOUND SHOWA DENKO K.K. (JP) 2023-06-29 US disclosed
US-9957376-B2 Optical material composition and use thereof ETERNAL MATERIALS CO., LTD. (TW) 2018-05-01 US disclosed
US-20160312009-A1 OPTICAL MATERIAL COMPOSITION AND USE THEREOF ETERNAL MATERIALS CO., LTD. (TW) 2016-10-27 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-20230202976-A1 METHOD FOR PRODUCING THIOL COMPOUND TST, TMT1A, MPST MMP1 3974/4885MMP2 4411/4885MMP3 4429/4885

“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.