SCHEMBL31472564

SCHEMBL31472564

Nc1cc(-c2c[nH]c3cnccc23)ccn1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 15/20 1.00
NFATC1 O95644 6/20 0.70
GSK3B P49841 6/20 0.67
PIM1 P11309 2/20 0.53
PIM3 Q86V86 1/20 0.53
PIM2 Q9P1W9 1/20 0.53
IMPDH2 P12268 1/20 0.52
CDK2 P24941 2/20 0.52
DYRK1B Q9Y463 2/20 0.52
IGF1R P08069 1/20 0.52
PDPK1 O15530 1/20 0.51
TGFBR1 P36897 1/20 0.51
IKBKE Q14164 1/20 0.51
HASPIN Q8TF76 1/20 0.51

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
SCHEMBL31588665 0.82 DYRK1A (0.69) DYRK1AGSK3BPIM1PIM3PIM2
SCHEMBL30461701 0.81 DYRK1A (1.00) DYRK1ANFATC1GSK3BPIM1IMPDH2
SCHEMBL25421202 0.81 DYRK1A (1.00) DYRK1ANFATC1GSK3BPIM1IMPDH2
SCHEMBL26696137 0.74 DYRK1A (0.80) DYRK1ANFATC1GSK3BPIM1IMPDH2
SCHEMBL18418490 0.73 TDO2 (0.72) DYRK1ANFATC1GSK3BPIM1IMPDH2
SCHEMBL3658484 0.73 DYRK1A (1.00) DYRK1ANFATC1GSK3BPIM1CDK2
SCHEMBL26703619 0.73 DYRK1A (0.66) DYRK1ANFATC1GSK3BIMPDH2CDK2
SCHEMBL13051138 0.73 DYRK1A (0.65) DYRK1ANFATC1GSK3BPIM1IMPDH2
SCHEMBL17179566 0.73 DYRK1A (1.00) DYRK1ANFATC1GSK3BPIM1PIM3
SCHEMBL25910370 0.73 DYRK1A (0.66) DYRK1ANFATC1GSK3BIMPDH2CDK2

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-20250099442-A1 COMPOUNDS FOR USE IN TREATING NEUROLOGICAL DISORDERS PROTHENA BIOSCIENCES INC 2025-03-27 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-20250099442-A1 COMPOUNDS FOR USE IN TREATING NEUROLOGICAL DISORDERS DYRK2, DYRK1A, DYRK1B DYRK1A 2/4885NFATC1 2381/4885GSK3B 80/4885

“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.