SCHEMBL24077092

SCHEMBL24077092

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

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.47
▸ RAB9A P51151 1/20 0.43
▸ L3MBTL1 Q9Y468 1/20 0.43
▸ PDE2A O00408 1/20 0.42
▸ KDM4E B2RXH2 3/20 0.40
▸ MAPT P10636 3/20 0.40
▸ ALDH1A1 P00352 4/20 0.40
▸ SMN1; SMN2 Q16637 3/20 0.40
▸ TSHR P16473 1/20 0.39
▸ GSK3B P49841 1/20 0.39
▸ PKM P14618 1/20 0.39
▸ LMNA P02545 2/20 0.39
▸ KMT2A Q03164 2/20 0.39
▸ AKR1B1 P15121 1/20 0.38
▸ NPSR1 Q6W5P4 1/20 0.38
▸ HSD17B10 Q99714 2/20 0.38
▸ HPGD P15428 1/20 0.38
▸ MEN1 O00255 1/20 0.37
▸ USP2 O75604 1/20 0.37
▸ PRMT5 O14744 1/20 0.37

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 0.82 PDE2A (0.44) PDE2AMAPTSMN1; SMN2GSK3BKMT2A
SCHEMBL30319413 0.80 POLB (0.47) POLBRAB9AL3MBTL1KDM4EALDH1A1
SCHEMBL30319379 0.79 POLB (0.72) POLBRAB9AL3MBTL1KDM4EALDH1A1
SCHEMBL30319315 0.79 POLB (0.50) POLBRAB9AL3MBTL1KDM4EALDH1A1
SCHEMBL24077389 0.78 ATM (0.44) POLBPDE2AMAPTSMN1; SMN2GSK3B
SCHEMBL25747887 0.74 AKR1B1 (0.42) POLBL3MBTL1MAPTAKR1B1
SCHEMBL25238551 0.74 NLRP3 (0.40) L3MBTL1MAPTAKR1B1
SCHEMBL24076899 0.74 MAPT (0.53) MAPTSMN1; SMN2GSK3BPKMPRMT5
SCHEMBL24076940 0.73 GAA (0.47) POLBL3MBTL1KDM4EMAPTKMT2A
SCHEMBL25747164 0.73 MAPT (0.42) POLBKDM4EMAPTSMN1; SMN2GSK3B

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-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
US-20230202989-A1 COMPOUNDS JANSSEN PHARMACEUTICA NV (BE) 2023-06-29 — — US disclosed
EP-4157823-A1 COMPOUNDS JANSSEN Pharmaceutica NV (BE) 2023-04-05 — — EP 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 POLB 3231/4885RAB9A 4615/4885L3MBTL1 3315/4885

“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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