SCHEMBL4993341

SCHEMBL4993341

Nc1ncnc2c1CCN(Cc1cccc(Cl)c1)C2

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
GAA P10253 2/20 0.51
ATM Q13315 2/20 0.51
LIMK1 P53667 1/20 0.50
SIGMAR1 Q99720 1/20 0.49
MKNK1 Q9BUB5 1/20 0.46
CLPP Q16740 7/20 0.45
DHFR P00374 2/20 0.43
DRD2 P14416 1/20 0.43
DRD4 P21917 1/20 0.43
DRD3 P35462 1/20 0.43
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
GLA P06280 1/20 0.41
MAPT P10636 1/20 0.41
HTT P42858 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
CYP3A4 P08684 1/20 0.41

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
SCHEMBL4982960 0.89 LIMK1 (0.61) MEN1KMT2AGAALIMK1MKNK1
SCHEMBL4992362 0.87 LIMK1 (0.48) MEN1KMT2ALIMK1SIGMAR1MKNK1
SCHEMBL4988843 0.87 ALDH1A1 (0.47) MEN1KMT2ALIMK1MKNK1CLPP
SCHEMBL4986127 0.87 LIMK1 (0.47) LIMK1MKNK1CLPPKDM4EALDH1A1
SCHEMBL4986172 0.87 SMN1; SMN2 (0.47) MEN1KMT2AGAAATMLIMK1
SCHEMBL4984842 0.85 MEN1 (0.48) MEN1KMT2AATMLIMK1SIGMAR1
SCHEMBL4985989 0.84 KDM4E (0.50) GAALIMK1MKNK1CLPPDRD2
SCHEMBL4988786 0.84 CLPP (0.51) LIMK1CLPP
SCHEMBL4985030 0.84 SIGMAR1 (0.50) MEN1KMT2AGAALIMK1SIGMAR1
SCHEMBL4985486 0.83 DRD2 (0.43) KMT2AGAALIMK1SIGMAR1MKNK1

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-20080039478-A1 Bicycloheteroaryl Compounds as P2X7 Modulators and Uses Thereof RENOVIS, INC. 2008-02-14 US claimed
US-7297700-B2 Bicycloheteroaryl compounds as P2X7 modulators and uses thereof RENOVIS, INC. (US) 2007-11-20 US claimed

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-20080039478-A1 Bicycloheteroaryl Compounds as P2X7 Modulators and Uses Thereof P2RX7, P2RX3, P2RX2 MEN1 4853/4885KMT2A 4614/4885GAA 4179/4885

“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.