SCHEMBL23780436

SCHEMBL23780436

Cc1nc(-c2ccc(CNC(=O)c3ccncc3O)cc2)no1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 2/20 0.48
▸ PLK1 P53350 1/20 0.48
▸ MAPK1 P28482 2/20 0.48
▸ ALDH1A1 P00352 1/20 0.48
▸ HPGDS O60760 1/20 0.46
▸ MAPT P10636 2/20 0.45
▸ HDAC1 Q13547 3/20 0.44
▸ KDM1A O60341 1/20 0.44
▸ HDAC6 Q9UBN7 2/20 0.43
▸ HDAC4 P56524 2/20 0.43
▸ CTSL P07711 1/20 0.43
▸ CTSB P07858 1/20 0.43
▸ CTSS P25774 1/20 0.43
▸ CTSK P43235 1/20 0.43
▸ POLB P06746 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ ALPL P05186 1/20 0.41
▸ HDAC8 Q9BY41 1/20 0.41
▸ ROCK2 O75116 1/20 0.41
▸ GRK2 P25098 1/20 0.41

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
SCHEMBL30172405 1.00 SMN1; SMN2 (0.48) SMN1; SMN2PLK1MAPK1ALDH1A1HPGDS
SCHEMBL21683299 0.78 PLK1 (0.58) SMN1; SMN2PLK1MAPTHDAC1HDAC6
SCHEMBL23780470 0.78 HDAC6 (0.62) PLK1MAPK1ALDH1A1HPGDSHDAC1
SCHEMBL23291895 0.77 PLK1 (0.57) SMN1; SMN2PLK1MAPK1ALDH1A1MAPT
SCHEMBL17706534 0.77 SMN1; SMN2 (0.49) SMN1; SMN2MAPK1ALDH1A1POLBROCK2
SCHEMBL23791596 0.75 PLK1 (0.55) SMN1; SMN2PLK1MAPK1MAPTHDAC1
SCHEMBL14284665 0.75 TSHR (0.60) SMN1; SMN2ALDH1A1KMT2A
SCHEMBL14284673 0.74 USP2 (0.59) MAPK1ALDH1A1HPGDSMAPTKMT2A
SCHEMBL23292063 0.74 HDAC1 (0.48) SMN1; SMN2PLK1HPGDSMAPTHDAC1
SCHEMBL21702506 0.72 L3MBTL1 (0.52) PLK1MAPTHDAC1HDAC6POLB

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
EP-3814343-B1 CARDIAC SARCOMERE INHIBITORS CYTOKINETICS INC (US) 2023-01-11 — — EP claimed
EP-3814343-B1 CARDIAC SARCOMERE INHIBITORS CYTOKINETICS INC (US) 2023-01-11 — — EP disclosed
US-20210276991-A1 CARDIAC SARCOMERE INHIBITORS CYTOKINETICS, INC. 2021-09-09 — — 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-20210276991-A1 CARDIAC SARCOMERE INHIBITORS TNNI3, TNNT2, MYLK2 SMN1; SMN2 74/4885PLK1 1581/4885MAPK1 196/4885

“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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