SCHEMBL31079424

SCHEMBL31079424

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

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 4/20 0.39
KDM1A O60341 1/20 0.39
TBK1 Q9UHD2 4/20 0.39
CHEK2 O96017 1/20 0.38
NEK2 P51955 2/20 0.37
GSK3B P49841 1/20 0.37
MAPK1 P28482 1/20 0.37
ALOX5AP P20292 1/20 0.37
FEN1 P39748 1/20 0.37
IKBKE Q14164 1/20 0.36
PDE4A P27815 1/20 0.36
PDE4B Q07343 1/20 0.36
PDE4C Q08493 1/20 0.36
PDE4D Q08499 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
SCHEMBL31079292 0.92 GPR119 (0.46) GPR119KDM1ATBK1CHEK2GSK3B
SCHEMBL31079210 0.91 MAPK1 (0.39) CHEK2GSK3BMAPK1FEN1
SCHEMBL29964825 0.91 PDE4B (0.45) GPR119KDM1ATBK1CHEK2GSK3B
SCHEMBL29965076 0.91 GPR119 (0.42) GPR119KDM1ATBK1CHEK2GSK3B
SCHEMBL29964618 0.90 TBK1 (0.49) GPR119KDM1ATBK1IKBKE
SCHEMBL29965015 0.89 CHEK2 (0.47) GPR119CHEK2GSK3BMAPK1ALOX5AP
SCHEMBL29964410 0.89 KDM1A (0.40) GPR119KDM1ATBK1CHEK2GSK3B
SCHEMBL29964821 0.88 GPR119 (0.41) GPR119KDM1ACHEK2GSK3BMAPK1
SCHEMBL29964802 0.87 SMARCA2 (0.40) GPR119GSK3BMAPK1
SCHEMBL29965510 0.87 GPR119 (0.38) GPR119KDM1ATBK1CHEK2GSK3B

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 1 patent. 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

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 GPR119 1816/4885KDM1A 1020/4885TBK1 1120/4885

“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.