SCHEMBL6461019

SCHEMBL6461019

CC(C)N1CCN([C@H]2CC[C@H](n3cc(-c4ccc(Oc5ccccc5)cc4)c4c(N)ncnc43)CC2)CC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HCK P08631 13/20 1.00
▸ LCK P06239 9/20 0.82
▸ SRC P12931 9/20 0.82
▸ FLT3 P36888 9/20 0.82
▸ TEK Q02763 8/20 0.82
▸ KDR P35968 4/20 0.82
▸ EGFR P00533 2/20 0.82
▸ FYN P06241 2/20 0.82
▸ LYN P07948 2/20 0.82
▸ CSK P41240 2/20 0.82
▸ BTK Q06187 2/20 0.82
▸ PRKD3 O94806 2/20 0.82
▸ PRKCD Q05655 2/20 0.82
▸ PLK4 O00444 1/20 0.82
▸ DCLK1 O15075 1/20 0.82
▸ PDPK1 O15530 1/20 0.82
▸ MAP4K4 O95819 1/20 0.82
▸ PAK4 O96013 1/20 0.82
▸ CHEK2 O96017 1/20 0.82
▸ ABL1 P00519 1/20 0.82

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
SCHEMBL6460510 1.00 HCK (1.00) HCKLCKSRCFLT3TEK
SCHEMBL6460515 1.00 HCK (1.00) HCKLCKSRCFLT3TEK
Fumaric Acid SCHEMBL6459070 0.94 HCK (0.88) HCKLCKSRCFLT3TEK
Fumaric Acid SCHEMBL6464977 0.94 HCK (0.88) HCKLCKSRCFLT3TEK
Maleic Acid SCHEMBL6464975 0.94 HCK (0.88) HCKLCKSRCFLT3TEK
Maleic Acid SCHEMBL6459065 0.94 HCK (0.88) HCKLCKSRCFLT3TEK
SCHEMBL14183078 0.90 SRC (1.00) HCKLCKSRCFLT3TEK
SCHEMBL16752413 0.90 SRC (1.00) HCKLCKSRCFLT3TEK
SCHEMBL14106768 0.90 SRC (1.00) HCKLCKSRCFLT3TEK
SCHEMBL16752462 0.90 SRC (1.00) HCKLCKSRCFLT3TEK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6713474-B2 SERINE-THREONINE AND TYROSINE KINASE INHIBITORS ABBOTT GMBH & CO. KG (DE) 2004-03-30 — — US claimed
US-20030153752-A1 Pyrrolopyrimidines as therapeutic agents ABBVIE DEUTSCHLAND GMBH & CO KG (DE) 2003-08-14 — — US claimed
US-20190255056-A1 A HCK INHIBITOR AND A BCL-2 INHIBITOR FOR TREATING ACUTE MYELOID LEUKEMIA RIKEN (JP) 2019-08-22 — — US disclosed
EP-2878601-B1 AGENT FOR TREATING OR CONTROLLING RECURRENCE OF ACUTE MYELOGENOUS LEUKEMIA RIKEN (JP) 2018-03-28 — — EP disclosed
EP-2878601-B1 AGENT FOR TREATING OR CONTROLLING RECURRENCE OF ACUTE MYELOGENOUS LEUKEMIA RIKEN (JP) 2018-03-28 — — EP disclosed
US-9604988-B2 Agent for treating or inhibiting recurrence of acute myeloid leukemia RIKEN (JP) 2017-03-28 — — US disclosed
US-9604988-B2 Agent for treating or inhibiting recurrence of acute myeloid leukemia RIKEN (JP) 2017-03-28 — — US disclosed
US-9604988-B2 Agent for treating or inhibiting recurrence of acute myeloid leukemia RIKEN (JP) 2017-03-28 — — US disclosed
US-20150210698-A1 AGENT FOR TREATING OR INHIBITING RECURRENCE OF ACUTE MYELOID LEUKEMIA RIKEN (JP) 2015-07-30 — — US disclosed
US-20150210698-A1 AGENT FOR TREATING OR INHIBITING RECURRENCE OF ACUTE MYELOID LEUKEMIA RIKEN (JP) 2015-07-30 — — US disclosed
US-20150210698-A1 AGENT FOR TREATING OR INHIBITING RECURRENCE OF ACUTE MYELOID LEUKEMIA RIKEN (JP) 2015-07-30 — — US disclosed
EP-2878601-A1 AGENT FOR TREATING OR CONTROLLING RECURRENCE OF ACUTE MYELOGENOUS LEUKEMIA Riken (JP) 2015-06-03 — — EP disclosed
EP-2878601-A1 AGENT FOR TREATING OR CONTROLLING RECURRENCE OF ACUTE MYELOGENOUS LEUKEMIA Riken (JP) 2015-06-03 — — EP disclosed
US-20050008640-A1 Method of treating transplant rejection ABBOTT LABORATORIES 2005-01-13 — — US disclosed
US-6713474-B2 SERINE-THREONINE AND TYROSINE KINASE INHIBITORS ABBOTT GMBH & CO. KG (DE) 2004-03-30 — — US disclosed
US-20030153752-A1 Pyrrolopyrimidines as therapeutic agents ABBVIE DEUTSCHLAND GMBH & CO KG (DE) 2003-08-14 — — 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 (4 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-20050008640-A1 Method of treating transplant rejection LCK, ZAP70, FYN HCK 107/4885LCK 1/4885SRC 46/4885
US-20030153752-A1 Pyrrolopyrimidines as therapeutic agents FLT1, FLT4, TFPI HCK 968/4885LCK 6/4885SRC 206/4885
US-20190255056-A1 A HCK INHIBITOR AND A BCL-2 INHIBITOR FOR TREATING ACUTE MYELOID LEUKEMIA MCL1, HCK, FLT3 HCK 2/4885LCK 67/4885SRC 147/4885
US-20150210698-A1 AGENT FOR TREATING OR INHIBITING RECURRENCE OF ACUTE MYELOID LEUKEMIA MCL1, BCOR, RUNX1 HCK 2686/4885LCK 3635/4885SRC 395/4885

“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.

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