SCHEMBL24393156

SCHEMBL24393156

Cc1nc(Cl)nc2c1cnn2C

nearest known ligand 0.62

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PDE2A O00408 14/20 0.62
KMT2A Q03164 4/20 0.51
GAA P10253 1/20 0.50
CYP1A2 P05177 1/20 0.47
CYP3A4 P08684 1/20 0.47
CYP2D6 P10635 1/20 0.47
CYP2C19 P33261 1/20 0.47
MEN1 O00255 2/20 0.45
KDM4E B2RXH2 1/20 0.40
ALDH1A1 P00352 1/20 0.40
MAPT P10636 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40

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
SCHEMBL55774 0.82 PDE2A (0.64) PDE2AKMT2AGAACYP1A2CYP3A4
SCHEMBL10307718 0.80 PDE2A (0.43) PDE2AKMT2AGAAMEN1KDM4E
SCHEMBL29685062 0.79 PDE2A (0.60) PDE2AKMT2AGAACYP1A2CYP3A4
SCHEMBL130521 0.79 PDE2A (0.60) PDE2AKMT2AGAACYP1A2CYP3A4
SCHEMBL30095667 0.79 PDE2A (0.60) PDE2AKMT2AGAACYP1A2CYP3A4
SCHEMBL25876223 0.78 PDE2A (0.40) PDE2AKMT2AGAACYP1A2CYP3A4
SCHEMBL25876283 0.78 PDE1A (0.44) PDE2AALDH1A1
SCHEMBL13828287 0.77 PDE2A (0.57) PDE2AKMT2AGAACYP1A2CYP3A4
SCHEMBL30095729 0.77 KDM4E (0.42) PDE2AKMT2AKDM4E
SCHEMBL29175001 0.77 KDM4E (0.42) PDE2AKMT2AKDM4E

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230234954-A1 COMPOUND USED AS RET KINASE INHIBITOR AND APPLICATION THEREOF TYK MEDICINES, INC. (CN) 2023-07-27 US disclosed
WO-2022091048-A1 ECTONUCLEOTIDE PYROPHOSPHATASE-PHOSPHODIESTERASE-1 (ENPP1) INHIBITORS AND USES THEREOF INTEGRAL BIOSCIENCES PRIVATE LIMITED (IN) 2022-05-05 WO 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-20230234954-A1 COMPOUND USED AS RET KINASE INHIBITOR AND APPLICATION THEREOF RET, ROR1, FGFR3 PDE2A 1000/4885KMT2A 585/4885GAA 1754/4885

“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.