SCHEMBL21330103

SCHEMBL21330103

COC1(c2ccccn2)CCOC1

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 6/20 0.43
TYK2 P29597 3/20 0.39
JAK1 P23458 1/20 0.39
OPRM1 P35372 8/20 0.39
DRD2 P14416 2/20 0.39
DRD3 P35462 2/20 0.39
CYP2D6 P10635 1/20 0.38
HRH3 Q9Y5N1 1/20 0.37
SLC6A2 P23975 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
SCHEMBL31691849 1.00 ALOX5 (0.43) ALOX5TYK2JAK1OPRM1DRD2
SCHEMBL23126514 0.87 SLC6A2 (0.39) ALOX5OPRM1DRD2DRD3CYP2D6
SCHEMBL24447308 0.81 GRIN1 (0.42) ALOX5OPRM1CYP2D6HRH3SLC6A2
SCHEMBL29546485 0.79 TYK2 (0.41) ALOX5TYK2JAK1
SCHEMBL21359003 0.78 TYK2 (0.35) ALOX5TYK2JAK1
SCHEMBL26685461 0.78 ALOX5 (0.38) ALOX5TYK2JAK1OPRM1CYP2D6
SCHEMBL15291844 0.77 HRH3 (0.36) ALOX5OPRM1DRD2DRD3CYP2D6
SCHEMBL21330129 0.76 TYK2 (0.42) ALOX5TYK2JAK1
SCHEMBL21329679 0.76 ALOX5 (0.44) ALOX5TYK2JAK1
SCHEMBL21329681 0.76 ALOX5 (0.44) ALOX5TYK2JAK1

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-20200255423-A1 INHIBITORS OF TYROSINE KINASE 2 MEDIATED SIGNALING ABBVIE INC (US) 2020-08-13 US disclosed
WO-2019178079-A9 INHIBITORS OF TYROSINE KINASE 2 MEDIATED SIGNALING ABBVIE INC. (US) 2019-12-12 WO disclosed
WO-2019178079-A1 INHIBITORS OF TYROSINE KINASE 2 MEDIATED SIGNALING ABBVIE INC. (US) 2019-09-19 WO disclosed
US-20190276450-A1 INHIBITORS OF TYROSINE KINASE 2 MEDIATED SIGNALING ABBVIE INC. 2019-09-12 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 (2 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-20190276450-A1 INHIBITORS OF TYROSINE KINASE 2 MEDIATED SIGNALING PTK2B, ABL1, BTK ALOX5 4798/4885TYK2 36/4885JAK1 41/4885
US-20200255423-A1 INHIBITORS OF TYROSINE KINASE 2 MEDIATED SIGNALING PTK2B, ABL1, BTK ALOX5 4798/4885TYK2 36/4885JAK1 41/4885

“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.