SCHEMBL18705362

SCHEMBL18705362

CC(C)(C)OC(=O)CCOCCOCCOCCOCCNC(=O)COc1cc(OCC(=O)NCCOCCOCCOCCOCCC(=O)OC(C)(C)C)cc(-c2cc(OCC(=O)NCCOCCOCCOCCOCCC(=O)OC(C)(C)C)cc(C(=O)NCCNC(=O)CCCC[C@@H]3SC[C@@H]4NC(=O)N[C@@H]43)c2)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CSNK2A2 P19784 1/20 0.54
CSNK2B P67870 1/20 0.54
CSNK2A1 P68400 1/20 0.54
CAMK2B Q13554 1/20 0.54
PRSS1 P07477 3/20 0.53
PRSS2 P07478 3/20 0.53
PRSS3 P35030 3/20 0.53
TPSAB1 Q15661 3/20 0.53
F2 P00734 2/20 0.53
PKM P14618 2/20 0.50
SORT1 Q99523 1/20 0.48
FOLH1 Q04609 5/20 0.47
L3MBTL3 Q96JM7 1/20 0.47
PLG P00747 2/20 0.46
ADORA2A P29274 1/20 0.46
ADORA2B P29275 1/20 0.46
NOXO1 Q8NFA2 1/20 0.46
GBA1 P04062 1/20 0.46
HSP90AB1 P08238 1/20 0.45
LY6K Q17RY6 1/20 0.44

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
SCHEMBL20520038 0.97 CSNK2A2 (0.51) CSNK2A2CSNK2BCSNK2A1CAMK2BPRSS1
SCHEMBL20520180 0.97 PRSS1 (0.55) CSNK2A2CSNK2BCSNK2A1CAMK2BPRSS1
SCHEMBL20520124 0.96 CSNK2A2 (0.54) CSNK2A2CSNK2BCSNK2A1CAMK2BPRSS1
SCHEMBL20519818 0.94 FOLH1 (0.53) CSNK2A2CSNK2BCSNK2A1CAMK2BPRSS1
SCHEMBL18736360 0.91 TDP1 (0.48) CSNK2A2CSNK2BCSNK2A1CAMK2BPRSS1
SCHEMBL18705344 0.91 CSNK2A2 (0.57) CSNK2A2CSNK2BCSNK2A1CAMK2BPRSS1
SCHEMBL18705384 0.90 PRSS1 (0.48) CSNK2A2CSNK2BCSNK2A1CAMK2BPRSS1
SCHEMBL18705379 0.89 CSNK2A2 (0.48) CSNK2A2CSNK2BCSNK2A1CAMK2BPRSS1
SCHEMBL18736359 0.87 ADORA2A (0.52) CSNK2A2CSNK2BCSNK2A1CAMK2BPRSS1
SCHEMBL20519968 0.87 FOLH1 (0.60) CSNK2A2CSNK2BCSNK2A1CAMK2BPRSS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210369850-A1 COMPOUNDS AND THERAPEUTIC USES THEREOF Centauri Therapeutics Limited (GB/GB) (GB) 2021-12-02 US disclosed
US-10953100-B2 Compounds and therapeutic uses thereof CENTUARI THERAPEUTICS LIMITED (GB/GB) (GB) 2021-03-23 US disclosed
US-20180280521-A1 COMPOUNDS AND THERAPEUTIC USES THEREOF CENTUARI THERAPEUTICS LIMITED (GB/GB) (GB) 2018-10-04 US disclosed
WO-2017060729-A1 COMPOUNDS AND THERAPEUTIC USES THEREOF CENTAURI THERAPEUTICS LIMITED (GB) 2017-04-13 WO 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 (3 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-20210369850-A1 COMPOUNDS AND THERAPEUTIC USES THEREOF CD47, MYD88, NFATC1 CSNK2A2 3598/4885CSNK2B 3959/4885CSNK2A1 3689/4885
US-10953100-B2 Compounds and therapeutic uses thereof CD47, MYD88, NFATC1 CSNK2A2 3598/4885CSNK2B 3959/4885CSNK2A1 3689/4885
US-20180280521-A1 COMPOUNDS AND THERAPEUTIC USES THEREOF CD47, MYD88, NFATC1 CSNK2A2 3598/4885CSNK2B 3959/4885CSNK2A1 3689/4885

“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.