SCHEMBL19857564

SCHEMBL19857564

COn1cnc2c(C(N)=O)cccc21

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 16/20 0.46
PKN1 Q16512 1/20 0.42
PKN2 Q16513 1/20 0.42
PLA2G2A P14555 1/20 0.39
ALOX15 P16050 1/20 0.39
PTGS2 P35354 1/20 0.39
KDM4E B2RXH2 1/20 0.38
L3MBTL1 Q9Y468 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
SCHEMBL7358397 0.81 PARP1 (0.41) PARP1PKN1PKN2KDM4EL3MBTL1
SCHEMBL27249587 0.80 PARP1 (0.47) PARP1PKN1PKN2KDM4EL3MBTL1
SCHEMBL16497015 0.78 PARP1 (0.49) PARP1KDM4EL3MBTL1
SCHEMBL8648021 0.75 LMNA (0.50) PARP1
SCHEMBL29829372 0.72 PI4KA (0.47) PARP1
SCHEMBL19857549 0.72 KDM4E (0.40) PARP1PKN1PKN2KDM4EL3MBTL1
SCHEMBL7363550 0.72 EGLN1 (0.35) PARP1PKN1PKN2KDM4EL3MBTL1
SCHEMBL29830227 0.71 HPGD (0.48) PARP1
SCHEMBL29829801 0.71 PARP1 (0.54) PARP1
SCHEMBL29829541 0.71 EGLN1 (0.49) PARP1

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-10174005-B2 Fused pyrimidines as inhibitors of p97 complex CLEAVE BIOSCIENCES, INC. (US) 2019-01-08 US disclosed
US-20180044325-A1 FUSED PYRIMIDINES AS INHIBITORS OF P97 COMPLEX CLEAVE BIOSCIENCES, INC. 2018-02-15 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-10174005-B2 Fused pyrimidines as inhibitors of p97 complex WDR77, POP1, PSMG3 PARP1 2231/4885PKN1 2746/4885PKN2 2343/4885
US-20180044325-A1 FUSED PYRIMIDINES AS INHIBITORS OF P97 COMPLEX WDR77, POP1, PSMG3 PARP1 2244/4885PKN1 2743/4885PKN2 2322/4885

“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.