SCHEMBL3344529

SCHEMBL3344529

COCCn1c(C)nnc1-c1ccc(C)c(C(N)=O)c1

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 5/20 0.40
TDP1 Q9NUW8 1/20 0.38
KDM4E B2RXH2 1/20 0.37
RECQL P46063 1/20 0.37
HSD17B10 Q99714 1/20 0.37
BRD4 O60885 1/20 0.37
ALDH1A1 P00352 1/20 0.36
USP2 O75604 1/20 0.36
TSHR P16473 1/20 0.36
MAPK1 P28482 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
CCNC P24863 1/20 0.36
CDK8 P49336 1/20 0.36
HASPIN Q8TF76 1/20 0.36
CDK19 Q9BWU1 1/20 0.36
ENPP3 O14638 1/20 0.36

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
SCHEMBL3346946 0.83 SMN1; SMN2 (0.41) TDP1KDM4ERECQLHSD17B10ALDH1A1
SCHEMBL3344533 0.81 TSHR (0.42) TDP1KDM4ERECQLHSD17B10BRD4
SCHEMBL3348740 0.79 ENPP3 (0.41) TDP1BRD4ALDH1A1MAPK1ENPP3
SCHEMBL3342745 0.75 KAT6A (0.42) KDM4EHSD17B10ALDH1A1TSHR
SCHEMBL3348705 0.70 SMN1; SMN2 (0.44) TDP1BRD4ALDH1A1MAPK1ENPP3
SCHEMBL27896049 0.67 KDM4E (0.55) TDP1KDM4EALDH1A1L3MBTL1
SCHEMBL3343751 0.66 WNT1 (0.39) TDP1BRD4TSHRENPP3
SCHEMBL3346118 0.66 SYK (0.40) TDP1HSD17B10BRD4ENPP3
SCHEMBL3342888 0.66 NNMT (0.48)
SCHEMBL3346669 0.65 MKNK1 (0.53) TDP1KDM4E

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-20100160384-A1 DIHYDROPYRIDONE AMIDES AS P2X7 MODULATORS ROCHE PALO ALTO LLC 2010-06-24 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-20100160384-A1 DIHYDROPYRIDONE AMIDES AS P2X7 MODULATORS P2RY1, P2RX6, P2RX3 PTGER4 388/4885TDP1 1578/4885KDM4E 2591/4885

“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.