SCHEMBL31691908

SCHEMBL31691908

Cc1cc2cnccc2[nH]1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DAO P14920 1/20 0.53
PDE3B Q13370 1/20 0.50
PDE3A Q14432 1/20 0.50
CYP2A6 P11509 1/20 0.47
KEAP1 Q14145 1/20 0.47
MAPT P10636 2/20 0.46
SNCA P37840 1/20 0.46
ACHE P22303 4/20 0.46
HRH4 Q9H3N8 1/20 0.44
AXL P30530 1/20 0.44
CLK2 P49760 2/20 0.42
CLK3 P49761 2/20 0.42
DYRK1A Q13627 2/20 0.42
KDR P35968 1/20 0.41
CDK4 P11802 1/20 0.39
CCND1 P24385 1/20 0.39
CNR2 P34972 1/20 0.38
NAMPT P43490 2/20 0.38
CYP2C9 P11712 1/20 0.38
NR3C1 P04150 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
SCHEMBL4805509 1.00 DAO (0.53) DAOPDE3BPDE3ACYP2A6KEAP1
SCHEMBL2464427 0.83 DAO (0.53) DAOPDE3BPDE3ACYP2A6KEAP1
SCHEMBL18772869 0.80 DAO (0.40) DAOPDE3BPDE3AMAPTSNCA
SCHEMBL13624349 0.79 DAO (0.49) DAOPDE3BPDE3AMAPTSNCA
SCHEMBL7380955 0.77 DAO (0.65) DAOPDE3BPDE3AMAPTSNCA
SCHEMBL1853725 0.75 DAO (0.53) DAOPDE3BPDE3AMAPTSNCA
SCHEMBL28383003 0.75 DAO (0.53) DAOPDE3BPDE3AMAPTSNCA
SCHEMBL27851181 0.75 DAO (0.53) DAOPDE3BPDE3AMAPTSNCA
SCHEMBL20004291 0.75 DAO (0.53) DAOPDE3BPDE3AMAPTSNCA
SCHEMBL28809999 0.75 DAO (0.53) DAOPDE3BPDE3AMAPTSNCA

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-20250304577-A1 TYK2 INHIBITORS BIOGEN MA INC. 2025-10-02 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-20250304577-A1 TYK2 INHIBITORS TYK2, JAK2, JAK1 DAO 2075/4885PDE3B 2421/4885PDE3A 2379/4885

“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.