SCHEMBL30406961

SCHEMBL30406961

CC(C)Cc1ncc2c(-c3ccc4ncccc4c3)c[nH]c2n1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DYRK1A Q13627 8/20 0.50
▸ CLK2 P49760 2/20 0.50
▸ CLK3 P49761 2/20 0.50
▸ CLK1 P49759 1/20 0.48
▸ CLK4 Q9HAZ1 1/20 0.48
▸ TLR8 Q9NR97 1/20 0.43
▸ TLR7 Q9NYK1 1/20 0.43
▸ NPC1 O15118 1/20 0.43
▸ POLB P06746 1/20 0.43
▸ RAB9A P51151 1/20 0.43
▸ DYRK1B Q9Y463 1/20 0.42
▸ SGK1 O00141 1/20 0.40
▸ CAMKK2 Q96RR4 1/20 0.40
▸ ADORA1 P30542 1/20 0.39
▸ AKR1C3 P42330 1/20 0.39
▸ AKR1C2 P52895 1/20 0.39
▸ PDGFRB P09619 1/20 0.39
▸ PDGFRA P16234 1/20 0.39
▸ TDO2 P48775 1/20 0.38
▸ CCNC P24863 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
SCHEMBL25157560 1.00 DYRK1A (0.50) DYRK1ACLK2CLK3CLK1CLK4
SCHEMBL30406516 0.88 TLR9 (0.39) DYRK1ACLK2CLK3CLK1CLK4
SCHEMBL25193507 0.88 TLR9 (0.39) DYRK1ACLK2CLK3CLK1CLK4
SCHEMBL25519946 0.85 TDO2 (0.54) DYRK1ACLK2CLK3CLK1CLK4
SCHEMBL30348108 0.83 DYRK1A (0.55) DYRK1ACLK2CLK3CLK1CLK4
SCHEMBL25157223 0.83 DYRK1A (0.55) DYRK1ACLK2CLK3CLK1CLK4
SCHEMBL25157491 0.81 DYRK1A (0.51) DYRK1ACLK2CLK3CLK1CLK4
SCHEMBL30348103 0.81 DYRK1A (0.51) DYRK1ACLK2CLK3CLK1CLK4
SCHEMBL25157220 0.81 DYRK1A (0.58) DYRK1ACLK2CLK3CLK1CLK4
SCHEMBL30348251 0.81 DYRK1A (0.58) DYRK1ACLK2CLK3CLK1CLK4

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 DYRK1A 1/4885CLK2 466/4885CLK3 1147/4885

“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.

Send feedback