SCHEMBL4986225

SCHEMBL4986225

NC(=O)c1n[c]c2c(n1)CN(C(=O)c1ccccc1F)CC2

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 2/20 0.46
KDM4E B2RXH2 3/20 0.41
ALDH1A1 P00352 2/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
TSHR P16473 2/20 0.41
HTT P42858 3/20 0.40
GABRA1 P14867 1/20 0.39
GABRA5 P31644 1/20 0.39
GABRA3 P34903 1/20 0.39
GABRA2 P47869 1/20 0.39
UBE2M P61081 1/20 0.39
DCUN1D1 Q96GG9 1/20 0.39
POLB P06746 1/20 0.39
TP53 P04637 1/20 0.39
GBA1 P04062 1/20 0.39
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA7 P43166 1/20 0.38
CA9 Q16790 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
SCHEMBL4989344 0.88 LMNA (0.43) GRM5KDM4EALDH1A1TSHRHTT
SCHEMBL4986741 0.87 PARP1 (0.41) GRM5HCRTR1HCRTR2
SCHEMBL4985089 0.87 KDM4E (0.42) GRM5KDM4EHTTUBE2MDCUN1D1
SCHEMBL4982578 0.87 HTT (0.50) ALDH1A1HTTGABRA1GABRA5GABRA3
SCHEMBL4989124 0.87 ALDH1A1 (0.50) KDM4EALDH1A1HTTUBE2MDCUN1D1
SCHEMBL4985376 0.86 P2RX7 (0.45) GBA1
SCHEMBL4988101 0.84 HTT (0.46) GRM5KDM4EALDH1A1TSHRHTT
SCHEMBL4985620 0.84 PTGS1 (0.43) GRM5TSHR
SCHEMBL4988635 0.84 EPHX2 (0.39)
SCHEMBL4991171 0.84 HCRTR1 (0.43) HCRTR1HCRTR2

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 GRM5 231/4885KDM4E 4128/4885ALDH1A1 3640/4885

“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.