SCHEMBL24717244

SCHEMBL24717244

CSc1nc(N2CCN(C(=O)OC(C)(C)C)CC2)c2cc(Cl)c(Br)c(F)c2n1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CXCR2 P25025 1/20 0.42
KCNH2 Q12809 2/20 0.41
TLR9 Q9NR96 1/20 0.41
GBA1 P04062 2/20 0.39
CNR1 P21554 1/20 0.39
CNR2 P34972 1/20 0.39
SUV39H2 Q9H5I1 4/20 0.38
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 1/20 0.38
MAPT P10636 1/20 0.38
KIT P10721 1/20 0.38
GRIA1 P42261 1/20 0.38
TSHR P16473 1/20 0.37
HTT P42858 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
HSD17B10 Q99714 1/20 0.37
BACE1 P56817 1/20 0.37
NR1H2 P55055 1/20 0.37
NR1H3 Q13133 1/20 0.37
MAP4K4 O95819 1/20 0.36

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
SCHEMBL29974294 1.00 CXCR2 (0.42) CXCR2KCNH2TLR9GBA1CNR1
SCHEMBL29409403 0.89 KCNH2 (0.42) CXCR2KCNH2TLR9GBA1CNR1
SCHEMBL29914108 0.89 GBA1 (0.43) CXCR2KCNH2TLR9GBA1CNR1
SCHEMBL24161673 0.89 GBA1 (0.43) CXCR2KCNH2TLR9GBA1CNR1
SCHEMBL16637001 0.89 KCNH2 (0.42) CXCR2KCNH2TLR9GBA1CNR1
SCHEMBL31658007 0.87 TSHR (0.52) CXCR2KCNH2TLR9GBA1CNR1
SCHEMBL30569579 0.87 KCNH2 (0.42) CXCR2KCNH2TLR9GBA1CNR1
SCHEMBL16636992 0.87 KCNH2 (0.42) CXCR2KCNH2TLR9GBA1CNR1
SCHEMBL18128414 0.87 TSHR (0.52) CXCR2KCNH2TLR9GBA1CNR1
SCHEMBL16636843 0.86 TLR9 (0.42) CXCR2KCNH2TLR9GBA1CNR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240228511-A1 SUBSTITUTED FUSED AZINES AS KRAS G12D INHIBITORS ELI LILLY AND COMPANY 2024-07-11 US disclosed
US-20240228511-A1 SUBSTITUTED FUSED AZINES AS KRAS G12D INHIBITORS ELI LILLY AND COMPANY 2024-07-11 US disclosed
EP-4329888-A1 2-AMINOBENZOTHIAZOLE COMPOUNDS AND METHODS OF USE THEREOF Amgen Inc. (US) 2024-03-06 EP disclosed
CN-117651700-A 2-aminobenzothiazole compounds and methods of use 安进公司 2024-03-05 CN disclosed
CN-117500799-A Substituted fused azines as KRAS G12D inhibitors 伊莱利利公司 2024-02-02 CN disclosed
WO-2022261154-A1 SUBSTITUTED FUSED AZINES AS KRAS G12D INHIBITORS ELI LILLY AND COMPANY (US) 2022-12-15 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-20240228511-A1 SUBSTITUTED FUSED AZINES AS KRAS G12D INHIBITORS KRAS, NRAS, TP53 CXCR2 489/4885KCNH2 1048/4885TLR9 3734/4885

“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.