SCHEMBL6522040

SCHEMBL6522040

Cc1ccc(-n2ccccc2=O)cc1C(N)=O

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
F10 P00742 10/20 0.43
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
SYK P43405 1/20 0.40
P2RX7 Q99572 1/20 0.39
KLKB1 P03952 2/20 0.39
MAPK1 P28482 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.37
LMNA P02545 2/20 0.37
ALDH1A1 P00352 1/20 0.37
MAPT P10636 1/20 0.37
HPGD P15428 1/20 0.37
HTT P42858 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
RAB9A P51151 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
SCHEMBL4591950 0.88 F10 (0.46) F10SYKKLKB1MAPK1
SCHEMBL6524527 0.84 CASP1 (0.40) F10MEN1KMT2AMAPK1LMNA
SCHEMBL3343070 0.82 ALDH1A1 (0.38) MEN1KMT2AMAPK1SMN1; SMN2LMNA
SCHEMBL3342474 0.81 POLB (0.47) MEN1KMT2AMAPK1SMN1; SMN2LMNA
SCHEMBL3342210 0.81 ALDH1A1 (0.49) MEN1KMT2AMAPK1LMNAALDH1A1
SCHEMBL1030894 0.79 F10 (0.47) F10SYKKLKB1
SCHEMBL13907449 0.79 KMT2A (0.53) F10MEN1KMT2AP2RX7MAPK1
SCHEMBL3340313 0.78 CRBN (0.46) MEN1KMT2AP2RX7MAPK1SMN1; SMN2
Hydrochloric Acid SCHEMBL4999282 0.78 F10 (0.47) F10SYKKLKB1
SCHEMBL6522042 0.78 MAPT (0.43) F10MEN1KMT2AP2RX7KLKB1

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-8435990-B2 Dihydropyrimidone amides as P2X7 modulators ROCHE PALO ALTO LLC (US) 2013-05-07 US disclosed
US-20110028502-A1 DIHYDROPYRIMIDONE AMIDES AS P2X7 MODULATORS BROTHERTON-PLEISS CHRISTINE E 2011-02-03 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 (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-20110028502-A1 DIHYDROPYRIMIDONE AMIDES AS P2X7 MODULATORS P2RY1, P2RX7, P2RX3 F10 2418/4885MEN1 2873/4885KMT2A 3668/4885

“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.