SCHEMBL24076276

SCHEMBL24076276

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

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 1/20 0.36
▸ PDE2A O00408 1/20 0.35
▸ KMT2A Q03164 2/20 0.34
▸ SMN1; SMN2 Q16637 2/20 0.34
▸ POLB P06746 1/20 0.34
▸ CYP1A2 P05177 1/20 0.34
▸ PGR P06401 2/20 0.34
▸ NPC1 O15118 3/20 0.33
▸ RAB9A P51151 3/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ PARP1 P09874 1/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ USP2 O75604 1/20 0.33
▸ HSD17B10 Q99714 1/20 0.33
▸ ROCK1 Q13464 2/20 0.33
▸ AURKB Q96GD4 1/20 0.33
▸ PRMT5 O14744 1/20 0.33
▸ WDR77 Q9BQA1 1/20 0.33
▸ ALPL P05186 1/20 0.32
▸ ALPI P09923 1/20 0.32

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
SCHEMBL24076861 0.89 PDE2A (0.44) MAPTPDE2AKMT2ASMN1; SMN2PARP1
SCHEMBL25746187 0.85 KMT2A (0.36) KMT2ASMN1; SMN2POLBCYP1A2NPC1
SCHEMBL29874776 0.79 TSHR (0.39) MAPTKMT2ASMN1; SMN2POLBCYP1A2
SCHEMBL24076274 0.78 HTT (0.43) SMN1; SMN2POLBKDM4EROCK1PRMT5
SCHEMBL24077389 0.77 ATM (0.44) MAPTPDE2AKMT2ASMN1; SMN2POLB
SCHEMBL24076877 0.76 MAPT (0.39) MAPTSMN1; SMN2PGRNPC1RAB9A
SCHEMBL24076281 0.76 POLB (0.40) MAPTPDE2ASMN1; SMN2POLBCYP1A2
SCHEMBL29874887 0.74 ROCK1 (0.48) MAPTCYP1A2KDM4EHSD17B10ROCK1
SCHEMBL29875213 0.73 TSHR (0.39) KMT2ASMN1; SMN2POLBCYP1A2PGR
SCHEMBL24077092 0.73 POLB (0.47) MAPTPDE2AKMT2ASMN1; SMN2POLB

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-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
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 MAPT 1004/4885PDE2A 1750/4885KMT2A 4649/4885

“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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