SCHEMBL21153005

SCHEMBL21153005

O=C1NCc2c(-c3ccccc3)csc21

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 1/20 0.43
MAP3K9 P80192 2/20 0.42
MAP3K11 Q16584 2/20 0.42
CLK4 Q9HAZ1 3/20 0.41
PARP10 Q53GL7 2/20 0.41
PARP11 Q9NR21 2/20 0.41
DYRK1B Q9Y463 2/20 0.41
TYRO3 Q06418 1/20 0.41
NTRK2 Q16620 1/20 0.41
CLK1 P49759 1/20 0.41
CLK2 P49760 1/20 0.41
CLK3 P49761 1/20 0.41
GRM2 Q14416 1/20 0.40
CDK5 Q00535 2/20 0.40
DYRK1A Q13627 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
LTK P29376 1/20 0.40
MST1R Q04912 1/20 0.40
DHPS P49366 2/20 0.38
CA12 O43570 1/20 0.38

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
SCHEMBL30331758 0.72 PARP10 (0.69) KDRCLK4PARP10PARP11DYRK1B
SCHEMBL21152310 0.71 CDK5 (0.44) CLK4PARP10PARP11DYRK1BTYRO3
SCHEMBL21152989 0.69 CLK4 (0.35) KDRMAP3K9MAP3K11CLK4PARP10
SCHEMBL21152480 0.67 PDE3B (0.33)
SCHEMBL30775203 0.67 PARP10 (0.45) KDRMAP3K9MAP3K11CLK4PARP10
SCHEMBL3043388 0.66 KDR (0.54) KDRMAP3K9MAP3K11CLK4PARP10
SCHEMBL3039949 0.66 MAP3K9 (0.50) KDRMAP3K9MAP3K11CLK4PARP10
SCHEMBL18170580 0.64 KDR (0.58) KDRMAP3K9MAP3K11CLK4NTRK2
SCHEMBL21152485 0.63 MAP3K9 (0.48) MAP3K9MAP3K11GRM2CA12CA9
SCHEMBL6036925 0.62 BACE1 (0.41) KDRCLK4DYRK1BTYRO3NTRK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3735404-B1 ASK1 INHIBITOR COMPOUNDS AND USES THEREOF SEAL ROCK THERAPEUTICS INC (US) 2023-11-29 EP disclosed
US-20210213006-A1 METHODS OF TREATING NEURODEGENERATIVE DISEASES Seal Rock Therapeutics, Inc. 2021-07-15 US disclosed
WO-2020046975-A1 METHODS OF TREATING NEURODEGENERATIVE DISEASES Seal Rock Therapeutics, Inc. (US) 2020-03-05 WO disclosed
WO-2019136025-A1 ASK1 INHIBITOR COMPOUNDS AND USES THEREOF Seal Rock Therapeutics, Inc. (US) 2019-07-11 WO 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-20210213006-A1 METHODS OF TREATING NEURODEGENERATIVE DISEASES SNCA, MAPT, HTT KDR 4574/4885MAP3K9 166/4885MAP3K11 135/4885

“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.