SCHEMBL24096504

SCHEMBL24096504

COc1ccc(CNc2nccc3c2c(-c2ccc(N)c(F)c2)nn3C2CC2)c(OC)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 5/20 0.41
▸ BTK Q06187 1/20 0.41
▸ PIK3CD O00329 1/20 0.40
▸ ABL1 P00519 1/20 0.40
▸ HCK P08631 1/20 0.40
▸ SRC P12931 1/20 0.40
▸ KDR P35968 1/20 0.40
▸ PIK3CA P42336 1/20 0.40
▸ PIK3CB P42338 1/20 0.40
▸ MTOR P42345 1/20 0.40
▸ PIK3CG P48736 1/20 0.40
▸ EPHB4 P54760 1/20 0.40
▸ PRKDC P78527 1/20 0.40
▸ PI4KB Q9UBF8 1/20 0.40
▸ CYP1A2 P05177 13/20 0.39
▸ CYP3A4 P08684 13/20 0.39
▸ CYP2C19 P33261 13/20 0.39
▸ TSHR P16473 10/20 0.39
▸ CLK4 Q9HAZ1 9/20 0.39
▸ ALDH1A1 P00352 8/20 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
SCHEMBL29998362 1.00 EGFR (0.41) EGFRBTKPIK3CDABL1HCK
SCHEMBL30321056 0.89 EGFR (0.39) EGFRBTKPIK3CDABL1HCK
SCHEMBL29998774 0.87 TP53 (0.41) EGFRCYP1A2CYP3A4CYP2C19TSHR
SCHEMBL24096641 0.87 TP53 (0.41) EGFRCYP1A2CYP3A4CYP2C19TSHR
SCHEMBL23966804 0.85 CYP1A2 (0.42) CYP1A2CYP3A4CYP2C19TSHRCLK4
SCHEMBL30180855 0.85 CYP1A2 (0.42) CYP1A2CYP3A4CYP2C19TSHRCLK4
SCHEMBL24651143 0.82 CYP1A2 (0.46) CYP1A2CYP3A4CYP2C19TSHRCLK4
SCHEMBL24651144 0.81 NPC1 (0.43) CYP1A2CYP3A4CYP2C19TSHRCLK4
SCHEMBL30499571 0.80 EGFR (0.40) EGFRBTKSRCCYP1A2CYP3A4
SCHEMBL27217791 0.80 NPC1 (0.42) CYP1A2CYP3A4CYP2C19TSHRCLK4

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
CN-117597346-A NEK7 inhibitors 哈利亚治疗公司 2024-02-23 — — CN disclosed
US-20230203045-A1 INHIBITORS OF NEK7 KINASE Halia Therapeutics, Inc. 2023-06-29 — — US disclosed
US-20230203045-A1 INHIBITORS OF NEK7 KINASE Halia Therapeutics, Inc. 2023-06-29 — — US disclosed
WO-2021252488-A1 INHIBITORS OF NEK7 KINASE Halia Therapeutics, Inc. (US) 2021-12-16 — — 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-20230203045-A1 INHIBITORS OF NEK7 KINASE NEK7, NEK1, NEK5 EGFR 4664/4885BTK 988/4885PIK3CD 1435/4885

“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.

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