SCHEMBL23442015

SCHEMBL23442015

CC(C)(C)OC(=O)N1CCC(Cn2ccc3ncc(Cl)nc32)CC1

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.42
PKM P14618 1/20 0.42
GPR119 Q8TDV5 9/20 0.42
TGFBR1 P36897 1/20 0.41
MET P08581 2/20 0.41
FAAH O00519 1/20 0.41
BACE1 P56817 1/20 0.41
MERTK Q12866 1/20 0.41
FNTA P49354 1/20 0.40
FNTB P49356 1/20 0.40
USP7 Q93009 1/20 0.40

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
SCHEMBL31001111 0.83 TGFBR1 (0.44) KDM4EPKMGPR119TGFBR1MET
SCHEMBL31001109 0.83 TGFBR1 (0.44) KDM4EPKMGPR119TGFBR1MET
SCHEMBL23442868 0.82 HCAR1 (0.47) GPR119MET
SCHEMBL31637159 0.81 TGFBR1 (0.44) KDM4EPKMGPR119TGFBR1FAAH
SCHEMBL17394745 0.79 GPR119 (0.46) KDM4EPKMGPR119TGFBR1FAAH
SCHEMBL17394748 0.79 BACE1 (0.43) KDM4EPKMGPR119TGFBR1FAAH
SCHEMBL17394747 0.78 BACE1 (0.47) KDM4EPKMGPR119TGFBR1BACE1
SCHEMBL19461156 0.78 FNTA (0.46) KDM4EPKMGPR119TGFBR1FAAH
SCHEMBL30963004 0.76 CHEK1 (0.46) TGFBR1
SCHEMBL31001071 0.75 NR3C1 (0.55) GPR119

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11634424-B2 Diazaindole derivative and use thereof as CHK1 inhibitor MEDSHINE DISCOVERY INC. (CN) 2023-04-25 US disclosed
US-20230017858-A1 DIAZAINDOLE DERIVATIVE AND USE THEREOF AS CHK1 INHIBITOR Shanghai Fosun Pharmaceutical Industrial Development Co., Ltd. (CN) 2023-01-19 US disclosed
WO-2021104461-A1 DIAZAINDOLE DERIVATIVE AND USE THEREOF AS CHK1 INHIBITOR 南京明德新药研发有限公司 2021-06-03 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-20230017858-A1 DIAZAINDOLE DERIVATIVE AND USE THEREOF AS CHK1 INHIBITOR CHEK1, CHEK2, DDB1 KDM4E 1878/4885PKM 992/4885GPR119 2271/4885
US-11634424-B2 Diazaindole derivative and use thereof as CHK1 inhibitor CHEK1, CHEK2, DDB1 KDM4E 1878/4885PKM 992/4885GPR119 2271/4885

“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.