SCHEMBL25124401

SCHEMBL25124401

CN1CCc2c1ccnc2-c1cn[nH]c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ROCK2 O75116 5/20 0.41
▸ ROCK1 Q13464 4/20 0.41
▸ CDC42BPB Q9Y5S2 4/20 0.41
▸ CDC42BPA Q5VT25 3/20 0.41
▸ ATR Q13535 1/20 0.40
▸ CLK2 P49760 2/20 0.37
▸ DYRK1A Q13627 2/20 0.37
▸ CLK3 P49761 1/20 0.37
▸ P2RX7 Q99572 1/20 0.37
▸ LRRK2 Q5S007 1/20 0.36
▸ GRM4 Q14833 2/20 0.35
▸ GRM8 O00222 1/20 0.35
▸ MAPK8 P45983 1/20 0.35
▸ JAK1 P23458 1/20 0.34
▸ AURKA O14965 1/20 0.34
▸ AURKB Q96GD4 1/20 0.34
▸ INCENP Q9NQS7 1/20 0.34
▸ TPX2 Q9ULW0 1/20 0.34
▸ SIGMAR1 Q99720 1/20 0.34
▸ CDK2 P24941 1/20 0.33

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
SCHEMBL24783932 0.76 UCHL1 (0.50) ROCK2ROCK1CDC42BPBCDC42BPAP2RX7
SCHEMBL25124487 0.76 CYP2A6 (0.46) ROCK2ROCK1CDC42BPBCDC42BPAATR
SCHEMBL24783753 0.71 UCHL1 (0.36) ROCK2ROCK1CDC42BPBCDC42BPALRRK2
SCHEMBL25124540 0.69 LRRK2 (0.34) ATRLRRK2
SCHEMBL24782839 0.69 CDK9 (0.41) LRRK2
SCHEMBL24783742 0.68 CLK2 (0.42) ROCK2CLK2DYRK1ACLK3MAPK8
SCHEMBL25124832 0.68 QDPR (0.33) —
SCHEMBL23432271 0.67 ADRA2A (0.33) ROCK1LRRK2
SCHEMBL25045778 0.67 ROCK2 (0.33) ROCK2ROCK1CDC42BPBCDC42BPALRRK2
SCHEMBL25124537 0.66 ATR (0.36) ATRDYRK1ALRRK2CDK2

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-20230109839-A1 THERAPEUTIC AGENT FOR TAUOPATHIES Sumitomo Pharma Co., Ltd. (JP) 2023-04-13 — — 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-20230109839-A1 THERAPEUTIC AGENT FOR TAUOPATHIES MAPT, PSEN1, PSEN2 ROCK2 3012/4885ROCK1 3194/4885CDC42BPB 2035/4885

“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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