SCHEMBL22852276

SCHEMBL22852276

CC(C)(C)OC(=O)Nc1ccc(C2=CCC(N3CCCC3)CC2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN2 P17706 1/20 0.44
PTPN1 P18031 1/20 0.44
PTPN6 P29350 1/20 0.44
CYP17A1 P05093 2/20 0.41
NAMPT P43490 2/20 0.41
PRKDC P78527 1/20 0.41
CD274 Q9NZQ7 1/20 0.41
CHRM1 P11229 1/20 0.41
BRD4 O60885 1/20 0.40
CREBBP Q92793 1/20 0.40
DRD2 P14416 1/20 0.40
PSMB8 P28062 1/20 0.40
LIPE Q05469 1/20 0.40
HRH3 Q9Y5N1 1/20 0.40
ABL1 P00519 1/20 0.39
RIN1 Q13671 1/20 0.39
SYK P43405 1/20 0.39
BCL2 P10415 1/20 0.39
BECN1 Q14457 1/20 0.39
NR1I3 Q14994 1/20 0.39

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
SCHEMBL22852326 0.98 PTPN2 (0.44) PTPN2PTPN1PTPN6CYP17A1NAMPT
SCHEMBL22852277 0.77 NAMPT (0.48) PTPN2PTPN1PTPN6NAMPTPRKDC
SCHEMBL22852325 0.74 NAMPT (0.48) PTPN2PTPN1PTPN6NAMPTPRKDC
SCHEMBL20865536 0.72 CYP17A1 (0.68) PTPN2PTPN1PTPN6CYP17A1NAMPT
SCHEMBL615178 0.71 PSMB8 (0.49) PTPN2PTPN1PTPN6CYP17A1NAMPT
SCHEMBL13055402 0.70 CYP17A1 (0.59) CYP17A1NAMPTDRD2PSMB8LIPE
SCHEMBL22895527 0.68 ABL1 (0.65) CYP17A1NAMPTABL1RIN1
SCHEMBL23728299 0.68 PSMB8 (0.48) PTPN2PTPN1PTPN6CYP17A1NAMPT
SCHEMBL29330323 0.68 NPC1 (0.53) PTPN2PTPN1PTPN6NAMPTDRD2
SCHEMBL25680801 0.68 MAPT (0.64) NAMPT

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
US-12612408-B2 Pyrazolone-fused pyrimidine compound, preparation method for same and applications thereof SHANGHAI PHARMACEUTICALS HOLDING CO., LTD. (CN) 2026-04-28 US disclosed
US-20220259210-A1 Pyrazolone-Fused Pyrimidine Compound, Preparation Method for Same and Applications Thereof SHANGHAI PHARMACEUTICALS HOLDING CO., LTD. (CN) 2022-08-18 US disclosed
EP-3992193-A1 PYRAZOLOPYRIMIDINE COMPOUND, PREPARATION METHOD FOR SAME, AND APPLICATIONS THEREOF Shanghai Pharmaceuticals Holding Co., Ltd. (CN) 2022-05-04 EP disclosed
WO-2020259703-A1 PYRAZOLOPYRIMIDINE COMPOUND, PREPARATION METHOD FOR SAME, AND APPLICATIONS THEREOF 上海医药集团股份有限公司 2020-12-30 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 (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-20220259210-A1 Pyrazolone-Fused Pyrimidine Compound, Preparation Method for Same and Applications Thereof WEE1, WEE2, PDXK PTPN2 1568/4885PTPN1 1670/4885PTPN6 1638/4885
US-12612408-B2 Pyrazolone-fused pyrimidine compound, preparation method for same and applications thereof WEE1, WEE2, TK1 PTPN2 1024/4885PTPN1 385/4885PTPN6 667/4885

“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.