SCHEMBL23897355

SCHEMBL23897355

COc1ccc(Cn2cc(-c3nc(S)nc4sccc34)cc(F)c2=O)cc1F

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ PKM P14618 2/20 0.41
▸ MAPT P10636 2/20 0.41
▸ GRK2 P25098 1/20 0.40
▸ P2RX7 Q99572 5/20 0.38
▸ TDP1 Q9NUW8 2/20 0.38
▸ DBH P09172 1/20 0.37
▸ SMN1; SMN2 Q16637 2/20 0.37
▸ ROCK2 O75116 1/20 0.37
▸ PKLR P30613 1/20 0.36
▸ BRD4 O60885 1/20 0.36
▸ ALDH1A1 P00352 4/20 0.35
▸ LMNA P02545 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ MAPK1 P28482 1/20 0.35
▸ KDM4E B2RXH2 1/20 0.35
▸ PDE5A O76074 1/20 0.34

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
SCHEMBL21019816 0.89 MAPT (0.41) PKMMAPTGRK2P2RX7TDP1
SCHEMBL23897356 0.78 GRK2 (0.43) MAPTGRK2P2RX7TDP1DBH
SCHEMBL29976343 0.76 SMN1; SMN2 (0.33) PKMMAPTGRK2P2RX7TDP1
SCHEMBL19806011 0.76 SMN1; SMN2 (0.33) PKMMAPTGRK2P2RX7TDP1
SCHEMBL20985635 0.75 SDHB (0.33) PKMMAPTGRK2P2RX7TDP1
SCHEMBL21020624 0.70 GRK2 (0.43) GRK2P2RX7DBHSMN1; SMN2ROCK2
SCHEMBL19806006 0.69 DBH (0.50) PKMMAPTGRK2P2RX7TDP1
SCHEMBL19806008 0.69 DBH (0.47) MAPTGRK2TDP1DBHSMN1; SMN2
SCHEMBL26313233 0.66 SDHB (0.49) MAPTGRK2TDP1DBHROCK2
SCHEMBL19806089 0.64 SDHB (0.49) MAPTSMN1; SMN2ALDH1A1KMT2AMAPK1

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-11725000-B2 Apoptosis inhibitors NATIONAL INSTITUTE OF BIOLOGICAL SCIENCES, BEIJING (CN) 2023-08-15 — — US disclosed
US-11725000-B2 Apoptosis inhibitors NATIONAL INSTITUTE OF BIOLOGICAL SCIENCES, BEIJING (CN) 2023-08-15 — — US disclosed
US-20210309647-A1 Apoptosis Inhibitors NATIONAL INSTITUTE OF BIOLOGICAL SCIENCES, BEIJING (CN) 2021-10-07 — — 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 (2 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-11725000-B2 Apoptosis inhibitors BAX, SDHA, SDHB PKM 716/4885MAPT 2304/4885GRK2 3248/4885
US-20210309647-A1 Apoptosis Inhibitors BAX, SDHA, SDHB PKM 716/4885MAPT 2304/4885GRK2 3248/4885

“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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