SCHEMBL23795595

SCHEMBL23795595

CCN1CCN(Cc2ccc(Nc3nc4ccc(Oc5ccnc(NC(C)=O)c5)c(C)c4n3C)cc2C(F)(F)F)CC1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 7/20 0.54
MKNK2 Q9HBH9 6/20 0.54
BCR P11274 5/20 0.54
MKNK1 Q9BUB5 5/20 0.54
MAPK14 Q16539 4/20 0.52
MAP3K20 Q9NYL2 3/20 0.52
BRAF P15056 8/20 0.51
CYP3A4 P08684 1/20 0.49
NTRK1 P04629 2/20 0.48
TEK Q02763 2/20 0.48
NTRK2 Q16620 2/20 0.48
RET P07949 2/20 0.48
MAP3K7 O43318 3/20 0.48
MAP4K2 Q12851 3/20 0.48
SRC P12931 2/20 0.47
HCK P08631 2/20 0.46
NR2C2 P49116 1/20 0.46
LCK P06239 2/20 0.46
STK25 O00506 1/20 0.46
CIT O14578 1/20 0.46

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
SCHEMBL26007842 0.92 BRAF (0.50) ABL1MKNK2BCRMKNK1MAPK14
SCHEMBL24007134 0.89 ABL1 (0.60) ABL1MKNK2BCRMKNK1BRAF
SCHEMBL23205750 0.88 ABL1 (0.53) ABL1MKNK2BCRMKNK1MAPK14
SCHEMBL24374953 0.88 BRAF (0.52) ABL1MKNK2BCRMKNK1BRAF
SCHEMBL24374421 0.87 BRAF (0.68) ABL1MKNK2BCRMKNK1BRAF
SCHEMBL24007133 0.87 ABL1 (0.55) ABL1MKNK2BCRMKNK1MAPK14
SCHEMBL23205579 0.87 ABL1 (0.52) ABL1MKNK2BCRMKNK1MAPK14
SCHEMBL24815081 0.86 BRAF (0.49) ABL1MKNK2BCRMKNK1BRAF
SCHEMBL24007814 0.86 MKNK2 (0.53) ABL1MKNK2BCRMKNK1MAPK14
SCHEMBL24007046 0.85 ABL1 (0.56) ABL1MKNK2BCRMKNK1MAPK14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230265075-A1 6-HETEROARYLOXY BENZIMIDAZOLES AND AZABENZIMIDAZOLES AS JAK2 INHIBITORS AJAX THERAPEUTICS, INC. 2023-08-24 US disclosed
US-11691963-B2 6-heteroaryloxy benzimidazoles and azabenzimidazoles as JAK2 inhibitors AJAX THERAPEUTICS, INC. (US) 2023-07-04 US disclosed
US-20230183204-A9 BENZIMIDAZOLE DERIVATIVES AND AZA-BENZIMIDAZOLE DERIVATIVES AS JANUS KINASE 2 INHIBITORS AND USES THEREOF DANA-FARBER CANCER INSTITUTE, INC. (US) 2023-06-15 US disclosed
US-20230183204-A9 BENZIMIDAZOLE DERIVATIVES AND AZA-BENZIMIDAZOLE DERIVATIVES AS JANUS KINASE 2 INHIBITORS AND USES THEREOF DANA-FARBER CANCER INSTITUTE, INC. (US) 2023-06-15 US disclosed
US-20220411403-A1 6-HETEROARYLOXY BENZIMIDAZOLES AND AZABENZIMIDAZOLES AS JAK2 INHIBITORS AJAX THERAPEUTICS, INC. 2022-12-29 US disclosed
US-20220127246-A1 BENZIMIDAZOLE DERIVATIVES AND AZA-BENZIMIDAZOLE DERIVATIVES AS JANUS KINASE 2 INHIBITORS AND USES THEREOF DANA-FARBER CANCER INSTITUTE, INC. (US) 2022-04-28 US disclosed
WO-2021226261-A1 6-HETEROARYLOXY BENZIMIDAZOLES AND AZABENZIMIDAZOLES AS JAK2 INHIBITORS AJAX THERAPEUTICS, INC. (US) 2021-11-11 WO disclosed
EP-3876930-A1 BENZIMIDAZOLE DERIVATIVES AND AZA-BENZIMIDAZOLE DERIVATIVES AS JANUS KINASE 2 INHIBITORS AND USES THEREOF Dana-Farber Cancer Institute, Inc. (US) 2021-09-15 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 (5 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-20220127246-A1 BENZIMIDAZOLE DERIVATIVES AND AZA-BENZIMIDAZOLE DERIVATIVES AS JANUS KINASE 2 INHIBITORS AND USES THEREOF JAK1, JAK2, JAK3 ABL1 18/4885MKNK2 585/4885BCR 1084/4885
US-20220411403-A1 6-HETEROARYLOXY BENZIMIDAZOLES AND AZABENZIMIDAZOLES AS JAK2 INHIBITORS JAK2, JAK3, STAT5B ABL1 7/4885MKNK2 700/4885BCR 74/4885
US-20230183204-A9 BENZIMIDAZOLE DERIVATIVES AND AZA-BENZIMIDAZOLE DERIVATIVES AS JANUS KINASE 2 INHIBITORS AND USES THEREOF JAK1, JAK2, JAK3 ABL1 18/4885MKNK2 585/4885BCR 1084/4885
US-20230265075-A1 6-HETEROARYLOXY BENZIMIDAZOLES AND AZABENZIMIDAZOLES AS JAK2 INHIBITORS JAK2, JAK3, STAT5B ABL1 7/4885MKNK2 700/4885BCR 74/4885
US-11691963-B2 6-heteroaryloxy benzimidazoles and azabenzimidazoles as JAK2 inhibitors JAK2, JAK3, STAT5B ABL1 7/4885MKNK2 700/4885BCR 74/4885

“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.