SCHEMBL20683042

SCHEMBL20683042

CCOC(C)(C)c1cc2c(cn1)C(NC(=O)OC(C)(C)C)CCCC2

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.34
BTK Q06187 4/20 0.33
BDKRB1 P46663 4/20 0.33
KDM4E B2RXH2 4/20 0.33
ALDH1A1 P00352 4/20 0.33
HPGD P15428 4/20 0.33
MEN1 O00255 3/20 0.33
CYP2D6 P10635 3/20 0.33
CYP3A4 P08684 2/20 0.33
CYP2C19 P33261 2/20 0.33
CYP1A2 P05177 2/20 0.33
PKM P14618 1/20 0.33
CDK9 P50750 1/20 0.33
CYP2C9 P11712 1/20 0.33
LMNA P02545 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL20683056 0.80 BTK (0.36) KMT2ABTKBDKRB1KDM4EALDH1A1
SCHEMBL29766403 0.80 BTK (0.36) KMT2ABTKBDKRB1KDM4EALDH1A1
SCHEMBL20683066 0.80 BTK (0.39) BTKALDH1A1CYP3A4CYP2C9
SCHEMBL29766427 0.80 BTK (0.39) BTKALDH1A1CYP3A4CYP2C9
SCHEMBL26073296 0.79 BTK (0.35) BTKALDH1A1CYP3A4CYP2C9
SCHEMBL26073300 0.76 BTK (0.34) BTKALDH1A1CYP3A4CYP2C9SMN1; SMN2
SCHEMBL29766231 0.76 BTK (0.34) BTKALDH1A1CYP3A4CYP2C9SMN1; SMN2
SCHEMBL25489102 0.76 BTK (0.34) BTKALDH1A1CYP3A4CYP2C9SMN1; SMN2
SCHEMBL20533283 0.74 BTK (0.34) BTKBDKRB1
SCHEMBL30522345 0.74 BTK (0.34) BTKBDKRB1

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-10961237-B2 Inhibiting agents for Bruton's tyrosine kinase BIOGEN MA INC. (US) 2021-03-30 US disclosed
US-20200239459-A1 INHIBITING AGENTS FOR BRUTON'S TYROSINE KINASE BIOGEN MA INC. 2020-07-30 US disclosed
US-10189829-B2 Inhibiting agents for Bruton's tyrosine kinase BIOGEN MA INC. (US) 2019-01-29 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 (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-10961237-B2 Inhibiting agents for Bruton's tyrosine kinase ABL1, BTK, LYN KMT2A 1735/4885BTK 2/4885BDKRB1 966/4885
US-20200239459-A1 INHIBITING AGENTS FOR BRUTON'S TYROSINE KINASE ABL1, BTK, LYN KMT2A 1735/4885BTK 2/4885BDKRB1 966/4885
US-10189829-B2 Inhibiting agents for Bruton's tyrosine kinase ABL1, BTK, LYN KMT2A 1735/4885BTK 2/4885BDKRB1 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.