SCHEMBL20176877

SCHEMBL20176877

Cc1ncc(Oc2cccnc2)cn1

nearest known ligand 0.60

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.60
TDP1 Q9NUW8 1/20 0.60
CYP11B1 P15538 1/20 0.56
CYP11B2 P19099 1/20 0.56
CYP19A1 P11511 3/20 0.50
LTA4H P09960 2/20 0.50
CHRNB2 P17787 5/20 0.47
CHRNA4 P43681 5/20 0.47
HTT P42858 1/20 0.46
ALDH1A1 P00352 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
GRM5 P41594 1/20 0.43
MAP4K4 O95819 1/20 0.42

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
SCHEMBL29972517 0.85 LMNA (0.60) LMNATDP1CYP11B1CYP11B2CYP19A1
SCHEMBL20176876 0.85 LMNA (0.60) LMNATDP1CYP11B1CYP11B2CYP19A1
SCHEMBL30535283 0.83 LMNA (0.82) LMNATDP1CYP11B1CYP11B2CYP19A1
SCHEMBL676142 0.83 LMNA (0.82) LMNATDP1CYP11B1CYP11B2CYP19A1
Potassium SCHEMBL6776357 0.81 LMNA (0.78) LMNATDP1CYP11B1CYP11B2CYP19A1
SCHEMBL754535 0.79 LTA4H (0.55) LMNATDP1CYP11B1CYP11B2LTA4H
SCHEMBL16114401 0.79 LMNA (0.75) LMNATDP1CYP11B1CYP11B2CYP19A1
SCHEMBL169035 0.78 LMNA (0.62) LMNATDP1CYP11B1CYP11B2CYP19A1
SCHEMBL20176875 0.78 LTA4H (0.39) LMNATDP1CYP11B1CYP11B2LTA4H
SCHEMBL14831395 0.78 LMNA (0.51) LMNATDP1CYP11B1CYP11B2CYP19A1

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-20190352276-A1 INHIBITORS OF BRUTON'S TYROSINE KINASE JOINT STOCK COMPANY "BIOCAD" (RU) 2019-11-21 US disclosed
WO-2018092047-A1 INHIBITORS OF BRUTON'S TYROSINE KINASE JOINT STOCK COMPANY "BIOCAD" (RU) 2018-05-24 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 (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-20190352276-A1 INHIBITORS OF BRUTON'S TYROSINE KINASE BTK, ABL1, CNKSR1 LMNA 946/4885TDP1 1826/4885CYP11B1 2214/4885

“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.