SCHEMBL6975238

SCHEMBL6975238

COc1ccc(C(=O)N2CCC(Nc3ccc(Cl)cc3)c3ccc(Cl)cc32)cc1OC

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ SPTLC2 O15270 4/20 1.00
▸ SPTLC3 Q9NUV7 1/20 0.46
▸ KDM4E B2RXH2 1/20 0.45
▸ TP53 P04637 1/20 0.45
▸ PDE4A P27815 1/20 0.44
▸ PDE4B Q07343 1/20 0.44
▸ PDE4C Q08493 1/20 0.44
▸ PDE4D Q08499 1/20 0.44
▸ BCHE P06276 2/20 0.44
▸ ACHE P22303 2/20 0.44
▸ GAA P10253 1/20 0.43
▸ POLB P06746 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ NR3C1 P04150 1/20 0.42
▸ LMNA P02545 1/20 0.42
▸ MEN1 O00255 1/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ ALDH1A1 P00352 1/20 0.42

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
SCHEMBL6981735 0.94 SPTLC2 (0.89) SPTLC2SPTLC3KDM4EPDE4APDE4B
SCHEMBL6981749 0.92 SPTLC2 (0.85) SPTLC2SPTLC3KDM4ETP53PDE4A
SCHEMBL6968663 0.91 SPTLC2 (0.84) SPTLC2SPTLC3KDM4ETP53PDE4A
SCHEMBL6982993 0.87 SPTLC2 (0.77) SPTLC2SPTLC3KDM4EPDE4APDE4B
SCHEMBL6983112 0.87 SPTLC2 (0.76) SPTLC2SPTLC3KDM4ETP53PDE4A
Hydrochloric Acid SCHEMBL6975644 0.86 SPTLC2 (0.75) SPTLC2SPTLC3KDM4EPDE4APDE4B
SCHEMBL6981585 0.86 SPTLC2 (0.75) SPTLC2SPTLC3KDM4EPDE4APDE4B
SCHEMBL19892939 0.84 SPTLC2 (0.76) SPTLC2SPTLC3KDM4ETP53PDE4A
SCHEMBL19893042 0.84 SPTLC2 (0.82) SPTLC2SPTLC3KDM4EPDE4APDE4B
SCHEMBL6973987 0.83 SPTLC2 (0.71) SPTLC2SPTLC3KDM4ETP53PDE4A

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030216398-A1 Soluble beta amyloid precursor protein secretion promoters TAKEDA CHEMICAL INDUSTRIES LTD. (JP) 2003-11-20 — — US disclosed
EP-1283055-A1 SOLUBLE BETA AMYLOID PRECURSOR PROTEIN SECRETION PROMOTERS Takeda Chemical Industries, Ltd. (JP) 2003-02-12 — — EP 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-20030216398-A1 Soluble beta amyloid precursor protein secretion promoters APP, BDNF, BACE1 SPTLC2 3161/4885SPTLC3 3614/4885KDM4E 4248/4885

“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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