SCHEMBL25948844

SCHEMBL25948844

Cc1nc(C)c2ccc(C)n2n1

nearest known ligand 0.33

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TNKS O95271 1/20 0.33
PARP1 P09874 1/20 0.33
TNKS2 Q9H2K2 1/20 0.33
DPP4 P27487 1/20 0.31
HAVCR2 Q8TDQ0 2/20 0.31
HSD17B10 Q99714 2/20 0.31
PDE10A Q9Y233 1/20 0.31
POLB P06746 2/20 0.30
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 1/20 0.30
LMNA P02545 1/20 0.30
MAPT P10636 1/20 0.30
TSHR P16473 1/20 0.30

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
SCHEMBL17175010 0.79 TNKS (0.31) TNKSPARP1TNKS2ALDH1A1
SCHEMBL10309385 0.70 PDE10A (0.45) HAVCR2HSD17B10PDE10A
SCHEMBL22087003 0.69 KDM4E (0.43) HSD17B10POLBKDM4EALDH1A1LMNA
SCHEMBL22855167 0.68 PLK1 (0.36) POLBALDH1A1
SCHEMBL23029946 0.67 HAVCR2 (0.39) HAVCR2HSD17B10PDE10AKDM4ELMNA
Hydrochloric Acid SCHEMBL31330005 0.65 HAVCR2 (0.35) HAVCR2HSD17B10PDE10AKDM4EMAPT
SCHEMBL11971106 0.65 CSNK1D (0.43) POLBALDH1A1
SCHEMBL17175156 0.65 EGFR (0.45) HSD17B10KDM4EALDH1A1MAPTTSHR
SCHEMBL23571429 0.65 NPC1 (0.47) POLBALDH1A1MAPTTSHR
SCHEMBL24857419 0.64 PDE10A (0.34) HAVCR2HSD17B10PDE10AKDM4ETSHR

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-20240216414-A1 Antiviral Agents and Nucleoside Analogs for Treatment of Zika Virus UNIV EMORY (US) 2024-07-04 US disclosed
US-20230242533-A9 SUBSTITUTED FUSED HETEROAROMATIC BICYCLIC COMPOUNDS AS KINASE INHIBITORS AND THE USE THEREOF Impact Therapeutics (Shanghai), Inc (CN) 2023-08-03 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 (2 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-20230242533-A9 SUBSTITUTED FUSED HETEROAROMATIC BICYCLIC COMPOUNDS AS KINASE INHIBITORS AND THE USE THEREOF ATR, CHEK1, CHEK2 TNKS 150/4885PARP1 218/4885TNKS2 240/4885
US-20240216414-A1 Antiviral Agents and Nucleoside Analogs for Treatment of Zika Virus SAMHD1, PNP, NUDT1 TNKS 1975/4885PARP1 2306/4885TNKS2 2723/4885

“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.