SCHEMBL29964618

SCHEMBL29964618

CC(C)(C)OC(=O)N1CCC(Oc2ccc(-c3cc(-c4ccc5c(c4)CCNC5=O)c(N)nc3F)cc2C#N)CC1

nearest known ligand 0.49

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TBK1 Q9UHD2 11/20 0.49
IKBKE Q14164 2/20 0.47
GPR119 Q8TDV5 7/20 0.43
ALK Q9UM73 1/20 0.40
KDM1A O60341 1/20 0.39

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
SCHEMBL29964752 0.93 TBK1 (0.48) TBK1IKBKEGPR119ALKKDM1A
SCHEMBL31079292 0.92 GPR119 (0.46) TBK1GPR119ALKKDM1A
SCHEMBL29964212 0.91 TBK1 (0.43) TBK1KDM1A
SCHEMBL29964825 0.90 PDE4B (0.45) TBK1IKBKEGPR119KDM1A
SCHEMBL29965076 0.90 GPR119 (0.42) TBK1GPR119KDM1A
SCHEMBL31079424 0.90 GPR119 (0.39) TBK1IKBKEGPR119KDM1A
SCHEMBL29965015 0.89 CHEK2 (0.47) GPR119ALK
SCHEMBL29964410 0.88 KDM1A (0.40) TBK1GPR119KDM1A
SCHEMBL29964821 0.87 GPR119 (0.41) GPR119KDM1A
SCHEMBL29965510 0.86 GPR119 (0.38) TBK1GPR119ALKKDM1A

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 396/4885GPR119 1816/4885

“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.