SCHEMBL4073798

SCHEMBL4073798

CCOC(=O)c1cnc(Cl)c([N+](=O)[O-])c1NC(C)C

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.43
PDE4B Q07343 1/20 0.40
SMN1; SMN2 Q16637 3/20 0.39
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
NPSR1 Q6W5P4 2/20 0.39
POLB P06746 2/20 0.39
GALR2 O43603 1/20 0.39
MITF O75030 1/20 0.39
LMNA P02545 1/20 0.39
HSP90AA1 P07900 1/20 0.39
HPGD P15428 1/20 0.39
XBP1 P17861 1/20 0.39
CCR6 P51684 1/20 0.39
GAA P10253 2/20 0.39
RXFP1 Q9HBX9 1/20 0.39
KDM4E B2RXH2 3/20 0.38
MAPT P10636 4/20 0.38
MEN1 O00255 3/20 0.38

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
SCHEMBL4766494 0.87 ALDH1A1 (0.46) ALDH1A1SMN1; SMN2NPC1RAB9ANPSR1
SCHEMBL4246885 0.86 ALDH1A1 (0.45) ALDH1A1PDE4BSMN1; SMN2NPSR1POLB
SCHEMBL4398405 0.81 SMN1; SMN2 (0.50) ALDH1A1PDE4BSMN1; SMN2NPC1RAB9A
SCHEMBL30846439 0.81 ALDH1A1 (0.49) ALDH1A1SMN1; SMN2NPC1RAB9ANPSR1
SCHEMBL27314724 0.81 ALDH1A1 (0.49) ALDH1A1SMN1; SMN2NPC1RAB9ANPSR1
SCHEMBL574989 0.81 ALDH1A1 (0.49) ALDH1A1SMN1; SMN2NPC1RAB9ANPSR1
SCHEMBL4067929 0.80 MEN1 (0.42) ALDH1A1PDE4BSMN1; SMN2POLBHPGD
SCHEMBL12861401 0.80 THRB (0.42) ALDH1A1PDE4BSMN1; SMN2NPSR1POLB
SCHEMBL17042260 0.79 NPSR1 (0.55) ALDH1A1PDE4BSMN1; SMN2RAB9AL3MBTL1
SCHEMBL14031475 0.79 ALDH1A1 (0.47) ALDH1A1SMN1; SMN2NPC1RAB9ANPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12421230-B2 Tricyclic heteroaryl compounds useful as IRAK4 inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2025-09-23 US disclosed
CN-115335380-B Tricyclic heteroaryl compounds useful as IRAK4 inhibitors 百时美施贵宝公司 2024-08-02 CN disclosed
EP-4100408-B1 TRICYCLIC HETEROARYL COMPOUNDS USEFUL AS IRAK4 INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2024-02-28 EP disclosed
EP-4100408-B1 TRICYCLIC HETEROARYL COMPOUNDS USEFUL AS IRAK4 INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2024-02-28 EP disclosed
US-20230114683-A1 TRICYCLIC HETEROARYL COMPOUNDS USEFUL AS IRAK4 INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2023-04-13 US disclosed
EP-4100408-A1 TRICYCLIC HETEROARYL COMPOUNDS USEFUL AS IRAK4 INHIBITORS Bristol-Myers Squibb Company (US) 2022-12-14 EP disclosed
CN-115335380-A Tricyclic heteroaryl compounds useful as IRAK4 inhibitors 百时美施贵宝公司 2022-11-11 CN disclosed
WO-2021158498-A1 TRICYCLIC HETEROARYL COMPOUNDS USEFUL AS IRAK4 INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2021-08-12 WO disclosed
WO-2021158498-A1 TRICYCLIC HETEROARYL COMPOUNDS USEFUL AS IRAK4 INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2021-08-12 WO disclosed
EP-1653961-A4 INHIBITORS OF AKT ACTIVITY SMITHKLINE BEECHAM CORP (US) 2009-04-01 EP disclosed
US-20080255143-A1 Inhibitors of Akt Activity SMITHKLINE BEECHAM CORPORATION (PA) 2008-10-16 US disclosed
US-20080255143-A1 Inhibitors of Akt Activity SMITHKLINE BEECHAM CORPORATION (PA) 2008-10-16 US disclosed
EP-1653961-A1 INHIBITORS OF AKT ACTIVITY SMITHKLINE BEECHAM CORPORATION (US) 2006-05-10 EP disclosed
WO-2005011700-A1 INHIBITORS OF Akt ACTIVITY SMITHKLINE BEECHAM CORPORATION (US) 2005-02-10 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 (3 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-20230114683-A1 TRICYCLIC HETEROARYL COMPOUNDS USEFUL AS IRAK4 INHIBITORS IRAK4, IRAK3, IRAK2 ALDH1A1 3424/4885PDE4B 1223/4885SMN1; SMN2 2554/4885
US-20080255143-A1 Inhibitors of Akt Activity PI4KB, PIK3CA, AKT2 ALDH1A1 4166/4885PDE4B 1291/4885SMN1; SMN2 3299/4885
US-12421230-B2 Tricyclic heteroaryl compounds useful as IRAK4 inhibitors IRAK4, IRAK3, IRAK2 ALDH1A1 3424/4885PDE4B 1223/4885SMN1; SMN2 2554/4885

“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.