SCHEMBL24399604

SCHEMBL24399604

COC(=O)c1cc(N2CCN(C)CC2)cc2c(NCc3ccc(OC)cc3OC)ncnc12

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AURKA O14965 6/20 0.50
RPS6KB1 P23443 5/20 0.50
MAPT P10636 1/20 0.48
CYP1A2 P05177 12/20 0.47
CYP3A4 P08684 12/20 0.47
CYP2C19 P33261 11/20 0.47
CLK4 Q9HAZ1 11/20 0.47
CYP2D6 P10635 10/20 0.47
HSD17B10 Q99714 9/20 0.47
ALDH1A1 P00352 8/20 0.47
USP2 O75604 7/20 0.47
LMNA P02545 7/20 0.47
MAPK1 P28482 7/20 0.47
CYP2C9 P11712 7/20 0.46
TSHR P16473 5/20 0.46
HIF1A Q16665 4/20 0.45
MEN1 O00255 3/20 0.45
KMT2A Q03164 3/20 0.45
ALOX15 P16050 2/20 0.45
AURKB Q96GD4 3/20 0.43

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
SCHEMBL25376065 0.93 AURKA (0.50) AURKARPS6KB1MAPTCYP1A2CYP3A4
SCHEMBL29638487 0.91 AURKA (0.49) AURKARPS6KB1MAPTCYP1A2CYP3A4
SCHEMBL25374488 0.91 AURKA (0.49) AURKARPS6KB1MAPTCYP1A2CYP3A4
SCHEMBL25375327 0.84 AURKA (0.49) AURKARPS6KB1MAPTCYP1A2CYP3A4
SCHEMBL24399596 0.84 AURKA (0.56) AURKARPS6KB1MAPTCYP1A2CYP3A4
SCHEMBL24399559 0.83 AURKA (0.55) AURKARPS6KB1MAPTCYP1A2CYP3A4
SCHEMBL30401990 0.83 AURKA (0.55) AURKARPS6KB1MAPTCYP1A2CYP3A4
SCHEMBL25375789 0.83 AURKA (0.55) AURKARPS6KB1MAPTCYP1A2CYP3A4
SCHEMBL24399745 0.81 AURKA (0.71) AURKARPS6KB1MAPTCYP1A2CYP3A4
SCHEMBL24399658 0.77 MAPT (0.48) AURKARPS6KB1MAPTCYP1A2CYP3A4

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 AURKA 2128/4885RPS6KB1 4099/4885MAPT 2751/4885

“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.