SCHEMBL24399703

SCHEMBL24399703

Nc1ncnc2c(I)ccnc12

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LIMK1 P53667 6/20 0.40
CLK1 P49759 2/20 0.40
MAP4K4 O95819 7/20 0.36
PI4KA P42356 4/20 0.35
PI4K2B Q8TCG2 4/20 0.35
PI4K2A Q9BTU6 4/20 0.35
PI4KB Q9UBF8 4/20 0.35
KDM4E B2RXH2 2/20 0.35
MEN1 O00255 2/20 0.35
USP2 O75604 2/20 0.35
ALDH1A1 P00352 2/20 0.35
EGFR P00533 2/20 0.35
LMNA P02545 2/20 0.35
TP53 P04637 2/20 0.35
HSP90AA1 P07900 2/20 0.35
HPGD P15428 2/20 0.35
ALOX15 P16050 2/20 0.35
SLC6A2 P23975 2/20 0.35
MAPK1 P28482 2/20 0.35
HTT P42858 2/20 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
SCHEMBL22845774 0.79 HSP90AA1 (0.41) KDM4EMEN1USP2ALDH1A1EGFR
SCHEMBL14574794 0.69 NAPRT (0.46) LIMK1CLK1KDM4EMEN1ALDH1A1
SCHEMBL23618573 0.69 ADORA2A (0.42) KDM4EMEN1USP2ALDH1A1EGFR
SCHEMBL998838 0.69 KDM4E (0.37) KDM4EMEN1USP2ALDH1A1EGFR
SCHEMBL21952695 0.67 CCR1 (0.50) KDM4EMEN1USP2ALDH1A1EGFR
SCHEMBL31728816 0.67 KDR (0.37) LIMK1CLK1MAP4K4PI4KBMEN1
SCHEMBL24399702 0.65 KDM4E (0.47) KDM4EALDH1A1HPGDALOX15TDP1
SCHEMBL2598441 0.64 CHEK1 (0.39) LIMK1MAP4K4KDM4EMEN1USP2
SCHEMBL31729307 0.64 MAP4K4 (0.35) LIMK1CLK1MAP4K4PI4KAPI4K2B
SCHEMBL30074472 0.64 CHEK1 (0.39) LIMK1MAP4K4KDM4EMEN1USP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230312556-A1 ARYLAMIDE COMPOUND, PHARMACEUTICAL COMPOSITION COMPRISING SAME, AND PREPARATION METHOD THEREFOR AND USE THEREOF SICHUAN KELUN-BIOTECH BIOPHARMACEUTICAL CO., LTD. (CN) 2023-10-05 US disclosed
US-20230312556-A1 ARYLAMIDE COMPOUND, PHARMACEUTICAL COMPOSITION COMPRISING SAME, AND PREPARATION METHOD THEREFOR AND USE THEREOF SICHUAN KELUN-BIOTECH BIOPHARMACEUTICAL CO., LTD. (CN) 2023-10-05 US disclosed
US-20230312556-A1 ARYLAMIDE COMPOUND, PHARMACEUTICAL COMPOSITION COMPRISING SAME, AND PREPARATION METHOD THEREFOR AND USE THEREOF SICHUAN KELUN-BIOTECH BIOPHARMACEUTICAL CO., LTD. (CN) 2023-10-05 US disclosed
EP-4238967-A1 ARYLAMIDE COMPOUND, PHARMACEUTICAL COMPOSITION COMPRISING SAME, AND PREPARATION METHOD THEREFOR AND USE THEREOF Sichuan Kelun-Biotech Biopharmaceutical Co., Ltd. (CN) 2023-09-06 EP disclosed
EP-4238967-A1 ARYLAMIDE COMPOUND, PHARMACEUTICAL COMPOSITION COMPRISING SAME, AND PREPARATION METHOD THEREFOR AND USE THEREOF Sichuan Kelun-Biotech Biopharmaceutical Co., Ltd. (CN) 2023-09-06 EP disclosed
CN-116096718-A Aryl amide compound, pharmaceutical composition containing same, preparation method and application thereof 四川科伦博泰生物医药股份有限公司 2023-05-09 CN disclosed
WO-2022089219-A1 ARYLAMIDE COMPOUND, PHARMACEUTICAL COMPOSITION COMPRISING SAME, AND PREPARATION METHOD THEREFOR AND USE THEREOF 四川科伦博泰生物医药股份有限公司 2022-05-05 WO disclosed
WO-2022089219-A1 ARYLAMIDE COMPOUND, PHARMACEUTICAL COMPOSITION COMPRISING SAME, AND PREPARATION METHOD THEREFOR AND USE THEREOF 四川科伦博泰生物医药股份有限公司 2022-05-05 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-20230312556-A1 ARYLAMIDE COMPOUND, PHARMACEUTICAL COMPOSITION COMPRISING SAME, AND PREPARATION METHOD THEREFOR AND USE THEREOF AHR, ARNT, NOTUM LIMK1 3604/4885CLK1 4573/4885MAP4K4 3874/4885

“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.