SCHEMBL26922809

SCHEMBL26922809

[N-]=[N+]=NCC(=O)c1ccc(Cl)c(Cl)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMO O15229 3/20 0.47
▸ TSHR P16473 1/20 0.47
▸ HSD11B1 P28845 1/20 0.44
▸ HDAC3 O15379 2/20 0.43
▸ HDAC4 P56524 2/20 0.43
▸ HDAC1 Q13547 2/20 0.43
▸ HDAC7 Q8WUI4 2/20 0.43
▸ HDAC2 Q92769 2/20 0.43
▸ HDAC10 Q969S8 2/20 0.43
▸ HDAC11 Q96DB2 2/20 0.43
▸ HDAC8 Q9BY41 2/20 0.43
▸ HDAC6 Q9UBN7 2/20 0.43
▸ HDAC9 Q9UKV0 2/20 0.43
▸ HDAC5 Q9UQL6 2/20 0.43
▸ KDM4E B2RXH2 1/20 0.42
▸ ALDH1A1 P00352 1/20 0.42
▸ AGTR1 P30556 1/20 0.42
▸ SRD5A2 P31213 1/20 0.42
▸ POLB P06746 1/20 0.41
▸ HPGD P15428 1/20 0.41

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
SCHEMBL14466949 0.81 GSK3B (0.52) TSHRHSD11B1KDM4EALDH1A1POLB
SCHEMBL23553623 0.79 ERCC5 (0.51) ALDH1A1HPGDHTT
SCHEMBL30041147 0.79 ERCC5 (0.51) ALDH1A1HPGDHTT
SCHEMBL17311212 0.78 CA12 (0.46) HDAC6KDM4EPOLB
SCHEMBL30368172 0.78 CA12 (0.46) HDAC6KDM4EPOLB
SCHEMBL13977503 0.76 ALDH1A1 (0.39) KDM4EALDH1A1
SCHEMBL18165114 0.76 KMO (0.53) KMOTSHRHSD11B1HDAC3HDAC4
SCHEMBL13977643 0.75 PTPN1 (0.56) HDAC1HDAC8KDM4EALDH1A1POLB
SCHEMBL28214996 0.75 NPC1 (0.48) KDM4EALDH1A1POLBHPGDHTT
SCHEMBL28984896 0.75 GSK3B (0.52) HSD11B1HDAC3HDAC4HDAC1HDAC7

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-20240174603-A1 MODULATORS OF PROTEIN PHOSPHATASE 2A (PP2A) AND METHODS USING SAME RAPPTA THERAPEUTICS OY (FI) 2024-05-30 — — US disclosed
EP-4288412-A1 MODULATORS OF PROTEIN PHOSPHATASE 2A (PP2A) AND METHODS USING SAME Rappta Therapeutics Oy (FI) 2023-12-13 — — EP disclosed
WO-2022167866-A1 MODULATORS OF PROTEIN PHOSPHATASE 2A (PP2A) AND METHODS USING SAME RAPPTA THERAPEUTICS OY (FI) 2022-08-11 — — 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-20240174603-A1 MODULATORS OF PROTEIN PHOSPHATASE 2A (PP2A) AND METHODS USING SAME PPM1A, PPP2CA, PPP3CA KMO 2128/4885TSHR 2069/4885HSD11B1 1193/4885

“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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