SCHEMBL29626601

SCHEMBL29626601

CON(C)C(=O)c1ccnc(NC(=O)OC(C)(C)C)c1

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ATR Q13535 1/20 0.43
CYP17A1 P05093 3/20 0.41
AAK1 Q2M2I8 3/20 0.41
GSK3B P49841 1/20 0.39
DYRK1A Q13627 1/20 0.39
IRAK4 Q9NWZ3 1/20 0.37
MLYCD O95822 1/20 0.36
IGF1R P08069 1/20 0.36
JAK2 O60674 1/20 0.36
JAK1 P23458 1/20 0.36
TYK2 P29597 1/20 0.36
NAMPT P43490 1/20 0.36
TGFBR1 P36897 1/20 0.36
PIK3C3 Q8NEB9 4/20 0.36
P2RX3 P56373 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
SCHEMBL6180657 1.00 ATR (0.43) ATRCYP17A1AAK1GSK3BDYRK1A
SCHEMBL6180055 0.83 NPC1 (0.40) GSK3BMLYCDPIK3C3
SCHEMBL29640073 0.83 ATR (0.53) ATRCYP17A1AAK1GSK3BDYRK1A
SCHEMBL27596021 0.83 PIK3C3 (0.49) JAK2JAK1TYK2PIK3C3
SCHEMBL14359967 0.83 ATR (0.53) ATRCYP17A1AAK1GSK3BDYRK1A
SCHEMBL2080457 0.81 KDM4D (0.47) ATRCYP17A1GSK3BDYRK1AIRAK4
SCHEMBL29465812 0.81 KDM4D (0.47) ATRCYP17A1GSK3BDYRK1AIRAK4
SCHEMBL29626657 0.81 CYP17A1 (0.46) ATRCYP17A1AAK1GSK3BDYRK1A
SCHEMBL6177797 0.81 CYP17A1 (0.46) ATRCYP17A1AAK1GSK3BDYRK1A
SCHEMBL13838444 0.81 GRIN2B (0.44) ATRCYP17A1GSK3BDYRK1AMLYCD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114450271-B Ureas, amino and substituted heteroaryl compounds for Cbl-b inhibition 纽力克斯治疗公司 2024-09-20 CN disclosed
US-20220387395-A1 UREA, AMIDE, AND SUBSTITUTED HETEROARYL COMPOUNDS FOR CBL-B INHIBITION NURIX THERAPEUTICS, INC. 2022-12-08 US disclosed
US-20220324835-A1 INHIBITORS OF CBL-B AND METHODS OF USE THEREOF NURIX THERAPEUTICS, INC. 2022-10-13 US disclosed
EP-4003965-A1 UREA, AMIDE, AND SUBSTITUTED HETEROARYL COMPOUNDS FOR CBL-B INHIBITION Nurix Therapeutics, Inc. (US) 2022-06-01 EP 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 (2 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-20220387395-A1 UREA, AMIDE, AND SUBSTITUTED HETEROARYL COMPOUNDS FOR CBL-B INHIBITION CBLB, CBL, CBLC ATR 712/4885CYP17A1 3746/4885AAK1 1605/4885
US-20220324835-A1 INHIBITORS OF CBL-B AND METHODS OF USE THEREOF CBLB, CBL, CBLC ATR 1042/4885CYP17A1 3953/4885AAK1 1256/4885

“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.