SCHEMBL29964644

SCHEMBL29964644

CC(C)(C)OC(=O)N1CCC[C@@H](Oc2ccc(-c3cc(-c4cc5c(cc4F)C(=O)NCC5)c(N)nc3F)cc2)C1

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CHEK2 O96017 4/20 0.48
PIM1 P11309 2/20 0.39
PIM2 Q9P1W9 2/20 0.39
BTK Q06187 2/20 0.39
ALOX5AP P20292 2/20 0.38
FEN1 P39748 2/20 0.38
TRPV3 Q8NET8 1/20 0.37
GPR119 Q8TDV5 1/20 0.36
ESR1 P03372 1/20 0.36
SRC P12931 1/20 0.35
PRMT5 O14744 1/20 0.35

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
SCHEMBL29965022 0.93 CHEK2 (0.39) CHEK2PIM1PIM2ALOX5APFEN1
SCHEMBL29964420 0.92 CHEK2 (0.49) CHEK2PIM1PIM2BTKALOX5AP
SCHEMBL29964866 0.92 CHEK2 (0.46) CHEK2ALOX5APFEN1GPR119
SCHEMBL29964643 0.85 P2RY14 (0.42) TRPV3GPR119
SCHEMBL29964469 0.84 PRKAB2 (0.39) CHEK2PRMT5
SCHEMBL29965247 0.84 MAPK1 (0.40) CHEK2PIM1PIM2ALOX5APFEN1
SCHEMBL29964443 0.83 RET (0.39) PIM1PIM2GPR119
SCHEMBL29964688 0.83 CHEK2 (0.42) CHEK2
SCHEMBL29965015 0.83 CHEK2 (0.47) CHEK2ALOX5APFEN1GPR119PRMT5
SCHEMBL29964221 0.83 GRM1 (0.41) BTK

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 CHEK2 162/4885PIM1 312/4885PIM2 519/4885

“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.