SCHEMBL26855727

SCHEMBL26855727

O=C1[C@@H](NO)c2ccccc2CN2CCCN12

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SPPL2A Q8TCT8 14/20 0.53
▸ XIAP P98170 1/20 0.35
▸ ALDH1A1 P00352 2/20 0.32
▸ CYP3A4 P08684 1/20 0.32
▸ CYP2D6 P10635 1/20 0.32
▸ CYP2C19 P33261 1/20 0.32
▸ HDAC4 P56524 1/20 0.32
▸ HDAC7 Q8WUI4 1/20 0.32
▸ HDAC5 Q9UQL6 1/20 0.32
▸ PSEN1 P49768 1/20 0.32
▸ PSEN2 P49810 1/20 0.32
▸ APH1B Q8WW43 1/20 0.32
▸ NCSTN Q92542 1/20 0.32
▸ APH1A Q96BI3 1/20 0.32
▸ PSENEN Q9NZ42 1/20 0.32
▸ KDM4E B2RXH2 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ HPGD P15428 1/20 0.32
▸ ALOX15 P16050 1/20 0.32
▸ TSHR P16473 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
SCHEMBL25407546 0.85 SPPL2A (0.60) SPPL2AXIAPALDH1A1CYP3A4CYP2D6
SCHEMBL25408370 0.85 SPPL2A (0.60) SPPL2AXIAPALDH1A1CYP3A4CYP2D6
SCHEMBL26847739 0.79 SPPL2A (0.54) SPPL2AXIAP
SCHEMBL31458717 0.79 SPPL2A (0.56) SPPL2AXIAPALDH1A1CYP3A4CYP2D6
SCHEMBL26847743 0.79 SPPL2A (0.54) SPPL2AXIAP
SCHEMBL25408033 0.79 SPPL2A (0.54) SPPL2AXIAP
SCHEMBL25408832 0.78 ANPEP (0.44) SPPL2A
SCHEMBL25410229 0.78 ANPEP (0.44) SPPL2A
SCHEMBL25409271 0.77 SPPL2A (0.69) SPPL2AXIAPPSEN1PSEN2APH1B
SCHEMBL25409277 0.77 SPPL2A (0.69) SPPL2AXIAPPSEN1PSEN2APH1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230365571-A1 COMPOUNDS AND COMPOSITIONS AS Sppl2a INHIBITORS NOVARTIS AG (CH) 2023-11-16 — — US 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-20230365571-A1 COMPOUNDS AND COMPOSITIONS AS Sppl2a INHIBITORS SPPL2A, SPPL2B, BACE1 SPPL2A 1/4885XIAP 202/4885ALDH1A1 3565/4885

“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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