SCHEMBL21557501

SCHEMBL21557501

COC(=O)C1Cc2ccc(B3OC(C)(C)C(C)(C)O3)cc2C1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.39
ROCK1 Q13464 1/20 0.38
DGAT1 O75907 1/20 0.38
HIF1A Q16665 5/20 0.38
PRMT5 O14744 1/20 0.36
WDR77 Q9BQA1 1/20 0.36
BACE1 P56817 3/20 0.36
BACE2 Q9Y5Z0 1/20 0.36
CA1 P00915 2/20 0.36
CA2 P00918 2/20 0.36
CA9 Q16790 2/20 0.36
CA12 O43570 1/20 0.36
CA3 P07451 1/20 0.36
CA4 P22748 1/20 0.36
CA6 P23280 1/20 0.36
CA5A P35218 1/20 0.36
CA7 P43166 1/20 0.36
CA14 Q9ULX7 1/20 0.36
CA5B Q9Y2D0 1/20 0.36
AAK1 Q2M2I8 1/20 0.36

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
SCHEMBL16252315 0.90 FAAH (0.40) ROCK1DGAT1HIF1ABACE1CA1
SCHEMBL795588 0.86 KDM4E (0.42) KMT2AROCK1HIF1APRMT5WDR77
SCHEMBL2556943 0.82 CA1 (0.39) ROCK1HIF1ACA1CA2CA9
SCHEMBL31394640 0.79 BACE1 (0.43) ROCK1BACE1CA1CA2CA9
SCHEMBL31393926 0.79 BACE1 (0.43) ROCK1BACE1CA1CA2CA9
SCHEMBL16100403 0.79 LIPG (0.41) ROCK1BACE1BACE2CA1CA2
SCHEMBL20563166 0.79 POLB (0.37) ROCK1DGAT1HIF1APRMT5WDR77
SCHEMBL28442898 0.78 ROCK1 (0.40) ROCK1HIF1APRMT5WDR77BACE1
SCHEMBL15096664 0.77 LIPG (0.42) ROCK1BACE1CA1CA2CA9
SCHEMBL15100254 0.77 PRMT5 (0.46) ROCK1DGAT1HIF1APRMT5WDR77

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10647710-B2 Thiazole derivative and applications thereof MEDSHINE DISCOVERY INC. (CN) 2020-05-12 US disclosed
EP-3566749-A1 THIAZOLE DERIVATIVE AND APPLICATIONS THEREOF Medshine Discovery Inc. (CN) 2019-11-13 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-10647710-B2 Thiazole derivative and applications thereof TSLP, TK2, TK1 KMT2A 4236/4885ROCK1 4574/4885DGAT1 3877/4885

“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.