SCHEMBL29965165

SCHEMBL29965165

N#Cc1cc(-c2cc(-c3ccc4c(c3)CCNC4=O)c(N)nc2F)ccc1OC1CCN(CC(F)(F)F)CC1

nearest known ligand 0.45

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TBK1 Q9UHD2 17/20 0.45
IKBKE Q14164 1/20 0.40
MAPK1 P28482 1/20 0.40
SGK1 O00141 1/20 0.38
KDM1A O60341 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
SCHEMBL31079030 0.92 TBK1 (0.44) TBK1IKBKESGK1
SCHEMBL31079270 0.90 MAPK1 (0.39) TBK1MAPK1
SCHEMBL29964560 0.88 MAPK1 (0.39) TBK1IKBKEMAPK1KDM1A
SCHEMBL29964554 0.88 MAPK1 (0.43) MAPK1SGK1
SCHEMBL31079134 0.87 MAPK1 (0.45) TBK1IKBKEMAPK1
SCHEMBL29964663 0.87 MAPK1 (0.41) TBK1MAPK1SGK1KDM1A
SCHEMBL29964212 0.86 TBK1 (0.43) TBK1MAPK1KDM1A
SCHEMBL29964618 0.84 TBK1 (0.49) TBK1IKBKEKDM1A
SCHEMBL29964610 0.81 TBK1 (0.37) TBK1IKBKEKDM1A
SCHEMBL31079135 0.81 MAPK1 (0.44) MAPK1

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-20240343704-A1 HALO-SUBSTITUTED AMINO PYRIDINE COMPOUNDS AS INHIBITORS OF THE HAEMATOPOIETIC PROGENITOR KINASE 1 (HPK1) ONTARIO INSTITUTE FOR CANCER RESEARCH (OICR) (CA) 2024-10-17 US disclosed
WO-2022226668-A1 HALO-SUBSTITUTED AMINO PYRIDINE COMPOUNDS AS INHIBITORS OF THE HAEMATOPOIETIC PROGENITOR KINASE 1 (HPK1) ONTARIO INSTITUTE FOR CANCER RESEARCH (OICR) (CA) 2022-11-03 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-20240343704-A1 HALO-SUBSTITUTED AMINO PYRIDINE COMPOUNDS AS INHIBITORS OF THE HAEMATOPOIETIC PROGENITOR KINASE 1 (HPK1) CMPK1, WNK1, AAK1 TBK1 1120/4885IKBKE 396/4885MAPK1 141/4885

“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.