SCHEMBL23850786

SCHEMBL23850786

N#Cc1ccc(N2CCCC(F)C2)c(N)c1

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HTT P42858 3/20 0.47
KDM4E B2RXH2 3/20 0.47
LRRK2 Q5S007 2/20 0.45
CSF1R P07333 1/20 0.40
ALDH1A1 P00352 3/20 0.39
GAA P10253 1/20 0.39
IRAK4 Q9NWZ3 1/20 0.39
MAPT P10636 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
S100B P04271 1/20 0.38
DRD2 P14416 4/20 0.37
DRD3 P35462 3/20 0.37
LMNA P02545 1/20 0.36
DPP4 P27487 1/20 0.35
CYP11B2 P19099 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
SCHEMBL31738557 1.00 HTT (0.47) HTTKDM4ELRRK2CSF1RALDH1A1
SCHEMBL31587376 1.00 HTT (0.47) HTTKDM4ELRRK2CSF1RALDH1A1
SCHEMBL23850784 1.00 HTT (0.47) HTTKDM4ELRRK2CSF1RALDH1A1
SCHEMBL31588227 0.84 GAA (0.41) HTTKDM4ELRRK2ALDH1A1GAA
SCHEMBL23851980 0.84 GAA (0.41) HTTKDM4ELRRK2ALDH1A1GAA
SCHEMBL23851235 0.84 SMARCA2 (0.46) HTTKDM4ELRRK2ALDH1A1GAA
SCHEMBL31587445 0.84 SMARCA2 (0.46) HTTKDM4ELRRK2ALDH1A1GAA
SCHEMBL23851634 0.84 SMARCA2 (0.46) HTTKDM4ELRRK2ALDH1A1GAA
SCHEMBL23851233 0.84 SMARCA2 (0.46) HTTKDM4ELRRK2ALDH1A1GAA
SCHEMBL31588159 0.84 SMARCA2 (0.46) HTTKDM4ELRRK2ALDH1A1GAA

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-20230064417-A1 COMPOUNDS Grey Wolf Therapeutics Limited (GB) 2023-03-02 US disclosed
EP-3883650-A1 COMPOUNDS Grey Wolf Therapeutics Limited (GB) 2021-09-29 EP disclosed
CN-113056305-A Compound (I) 格雷沃尔夫治疗有限公司 2021-06-29 CN 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-20230064417-A1 COMPOUNDS H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, HRH4, CBR3 HTT 297/4885KDM4E 2853/4885LRRK2 1016/4885

“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.