SCHEMBL30407002

SCHEMBL30407002

FC(F)(F)O[C@H]1CC[C@@H](Nc2ncc3cc[nH]c3n2)CC1

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ ULK1 O75385 7/20 0.48
▸ PAK1 Q13153 1/20 0.38
▸ MAPK8 P45983 5/20 0.38
▸ MAPK10 P53779 3/20 0.38
▸ CD38 P28907 1/20 0.37
▸ MAPK9 P45984 2/20 0.36
▸ SYK P43405 2/20 0.35
▸ ULK2 Q8IYT8 1/20 0.35
▸ ADRA2A P08913 1/20 0.35
▸ NPY5R Q15761 1/20 0.35
▸ MCHR1 Q99705 1/20 0.35
▸ KIT P10721 1/20 0.35
▸ FLT3 P36888 1/20 0.35
▸ RIPK2 O43353 1/20 0.34
▸ RET P07949 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
SCHEMBL30346548 0.83 RET (0.47) ULK1MAPK8MAPK10MAPK9RET
SCHEMBL10165915 0.80 MAPK8 (0.56) ULK1MAPK8MAPK10MAPK9FLT3
SCHEMBL16266502 0.76 MAPK1 (0.53) ULK1MAPK8MAPK10MAPK9RET
SCHEMBL30406752 0.74 LRRK2 (0.39) ULK1PAK1MAPK8MAPK10MAPK9
SCHEMBL30348299 0.71 ULK1 (0.40) ULK1RET
SCHEMBL25520279 0.71 ULK1 (0.40) ULK1RET
SCHEMBL22241892 0.69 JAK1 (0.52) MAPK8MAPK10MAPK9SYK
SCHEMBL32685539 0.69 PIM1 (0.33) ULK1MAPK8CD38SYKULK2
SCHEMBL25200864 0.69 TDO2 (0.47) RET
SCHEMBL25265742 0.69 TDO2 (0.47) RET

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-20230167133-A1 7H-PYRROLO[2,3-D]PYRIMIDINES AND PREPARATION AND USES THEREOF VICKERS VENTURE FUND VI PTE. LTD. (SG) 2023-06-01 — — US claimed

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-20230167133-A1 7H-PYRROLO[2,3-D]PYRIMIDINES AND PREPARATION AND USES THEREOF DYRK1A, DYRK1B, DYRK2 ULK1 266/4885PAK1 424/4885MAPK8 1482/4885

“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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