SCHEMBL24076884

SCHEMBL24076884

CC(C)(O)c1n[nH]c(=O)c2ccc(C(F)(F)F)cc12

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.47
▸ KMT2A Q03164 2/20 0.47
▸ MAPT P10636 3/20 0.44
▸ PARP1 P09874 1/20 0.42
▸ AURKB Q96GD4 1/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ PRMT5 O14744 1/20 0.40
▸ WDR77 Q9BQA1 1/20 0.40
▸ MAP2K4 P45985 4/20 0.40
▸ MAPK1 P28482 3/20 0.40
▸ MAPK6 Q16659 3/20 0.40
▸ MAPKAPK3 Q16644 2/20 0.40
▸ GSK3B P49841 1/20 0.40
▸ MAPKAPK2 P49137 1/20 0.40
▸ KIF11 P52732 2/20 0.40
▸ MAPKAPK5 Q8IW41 1/20 0.39
▸ NOTUM Q6P988 1/20 0.38

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
SCHEMBL30168572 1.00 MEN1 (0.47) MEN1KMT2AMAPTPARP1AURKB
SCHEMBL25747164 0.81 MAPT (0.42) MAPTPARP1AURKBSMN1; SMN2PRMT5
SCHEMBL25746163 0.80 CHEK1 (0.39) KMT2AMAPTPARP1AURKBPRMT5
SCHEMBL24076277 0.78 DAO (0.38) KMT2AMAPTPARP1PRMT5WDR77
SCHEMBL24077389 0.78 ATM (0.44) MEN1KMT2AMAPTPARP1AURKB
SCHEMBL24076861 0.77 PDE2A (0.44) MEN1KMT2AMAPTPARP1AURKB
SCHEMBL24076862 0.77 MAPT (0.47) MAPTPARP1AURKBSMN1; SMN2PRMT5
SCHEMBL24076899 0.77 MAPT (0.53) MAPTPARP1SMN1; SMN2PRMT5WDR77
SCHEMBL29426569 0.77 MAPT (0.44) MAPTPARP1AURKBSMN1; SMN2PRMT5
SCHEMBL24076896 0.77 MAPT (0.44) MAPTPARP1AURKBSMN1; SMN2PRMT5

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-20230202989-A1 COMPOUNDS JANSSEN PHARMACEUTICA NV (BE) 2023-06-29 — — US disclosed
US-20230202989-A1 COMPOUNDS JANSSEN PHARMACEUTICA NV (BE) 2023-06-29 — — US disclosed
CN-115667225-A Compound (I) 詹森药业有限公司 2023-01-31 — — CN disclosed
WO-2021239885-A1 COMPOUNDS JANSSEN PHARMACEUTICA NV (BE) 2021-12-02 — — 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-20230202989-A1 COMPOUNDS NLRP3, NLRP1, IL1B MEN1 1965/4885KMT2A 4649/4885MAPT 1004/4885

“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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