SCHEMBL29660139

SCHEMBL29660139

COc1ccc2c(c1)sc1nccn12

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PARP15 Q460N3 2/20 0.62
▸ PARP10 Q53GL7 2/20 0.62
▸ TNKS2 Q9H2K2 2/20 0.62
▸ PARP2 Q9UGN5 2/20 0.62
▸ MAPT P10636 5/20 0.54
▸ SMN1; SMN2 Q16637 3/20 0.54
▸ LMNA P02545 3/20 0.54
▸ TP53 P04637 3/20 0.54
▸ TSHR P16473 2/20 0.54
▸ RAB9A P51151 1/20 0.54
▸ ATM Q13315 1/20 0.54
▸ TDP1 Q9NUW8 1/20 0.54
▸ APP P05067 1/20 0.50
▸ ALDH1A1 P00352 2/20 0.49
▸ KDM4E B2RXH2 1/20 0.46
▸ HPGD P15428 1/20 0.41
▸ PDE11A Q9HCR9 1/20 0.41
▸ PTPN11 Q06124 1/20 0.40
▸ RXFP1 Q9HBX9 1/20 0.40
▸ CYP1A2 P05177 1/20 0.40

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
SCHEMBL17129984 1.00 PARP15 (0.62) PARP15PARP10TNKS2PARP2MAPT
SCHEMBL17129983 0.78 MAPT (0.69) PARP15PARP10TNKS2PARP2MAPT
SCHEMBL11750178 0.77 TNKS2 (1.00) PARP15PARP10TNKS2PARP2MAPT
Hydrochloric Acid SCHEMBL10465281 0.77 MAPT (0.67) PARP15PARP10TNKS2PARP2MAPT
SCHEMBL13404813 0.77 MAPT (0.44) MAPTSMN1; SMN2LMNATP53RAB9A
SCHEMBL19409255 0.76 PARP15 (0.59) PARP15PARP10TNKS2PARP2MAPT
SCHEMBL20893223 0.76 IDO1 (0.46) PARP15PARP10TNKS2PARP2MAPT
SCHEMBL11208936 0.76 PARP2 (0.37) PARP15PARP10TNKS2PARP2MAPT
SCHEMBL13394601 0.73 MAPT (0.64) PARP15PARP10TNKS2PARP2MAPT
SCHEMBL3590164 0.72 CYP2A6 (0.38) PARP15PARP10TNKS2PARP2ALDH1A1

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-11344637-B2 Probes for imaging huntingtin protein CHDI FOUNDATION, INC. (US) 2022-05-31 — — 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-11344637-B2 Probes for imaging huntingtin protein HTT, HYPK, HSPBP1 PARP15 2848/4885PARP10 2669/4885TNKS2 3921/4885

“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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