SCHEMBL31582535

SCHEMBL31582535

COC(=O)Nc1nnc(-c2ccccc2)c(-c2ccccc2)n1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.67
▸ ALDH1A1 P00352 5/20 0.59
▸ KDM4E B2RXH2 3/20 0.54
▸ LMNA P02545 3/20 0.54
▸ SMN1; SMN2 Q16637 2/20 0.54
▸ GAA P10253 2/20 0.54
▸ ALOX5 P09917 1/20 0.54
▸ HPGD P15428 2/20 0.53
▸ HSD17B10 Q99714 2/20 0.53
▸ PKM P14618 1/20 0.53
▸ NPSR1 Q6W5P4 3/20 0.49
▸ MAPT P10636 1/20 0.49
▸ HTT P42858 1/20 0.49
▸ TSHR P16473 1/20 0.47
▸ GPR84 Q9NQS5 1/20 0.43
▸ ADORA2A P29274 4/20 0.42
▸ ADORA1 P30542 4/20 0.42
▸ MEN1 O00255 1/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ PTGES O14684 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
SCHEMBL28493950 0.88 POLB (0.52) POLBALDH1A1KDM4ELMNASMN1; SMN2
SCHEMBL31582377 0.81 POLB (0.66) POLBALDH1A1KDM4ELMNASMN1; SMN2
SCHEMBL31582291 0.80 POLB (0.65) POLBALDH1A1KDM4ELMNASMN1; SMN2
SCHEMBL30738275 0.78 POLB (0.62) POLBALDH1A1KDM4ELMNASMN1; SMN2
SCHEMBL2323756 0.78 ALDH1A1 (0.67) POLBALDH1A1KDM4ELMNASMN1; SMN2
SCHEMBL31582421 0.77 ALDH1A1 (0.54) POLBALDH1A1KDM4ELMNASMN1; SMN2
SCHEMBL7244671 0.76 ALDH1A1 (0.51) ALDH1A1KDM4ELMNASMN1; SMN2GAA
SCHEMBL11272208 0.75 GAA (0.60) POLBALDH1A1KDM4ELMNASMN1; SMN2
SCHEMBL2834317 0.74 ALDH1A1 (1.00) POLBALDH1A1KDM4ELMNASMN1; SMN2
SCHEMBL31582349 0.72 POLB (0.55) POLBALDH1A1KDM4ELMNASMN1; SMN2

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-20250163006-A1 New Coolants, and Preparations Containing Same SYMRISE AG (DE) 2025-05-22 — — US claimed
WO-2025132323-A1 COMPOSITIONS COMPRISING A SUNSCREEN ACTIVE AGENT DSM-FIRMENICH AG (CH) 2025-06-26 — — WO disclosed
US-20250163006-A1 New Coolants, and Preparations Containing Same SYMRISE AG (DE) 2025-05-22 — — 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-20250163006-A1 New Coolants, and Preparations Containing Same TTR, TAS2R5, TAS2R50 POLB 2898/4885ALDH1A1 811/4885KDM4E 4049/4885

“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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