SCHEMBL5437218

SCHEMBL5437218

CCc1nc2c(=O)n(-c3ccc(C)cc3)cnc2[nH]1

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.46
NPC1 O15118 2/20 0.46
RAB9A P51151 2/20 0.46
KMT2A Q03164 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
LMNA P02545 1/20 0.46
XDH P47989 1/20 0.45
HCAR1 Q9BXC0 1/20 0.44
GRM1 Q13255 16/20 0.42
GRM5 P41594 2/20 0.37
KDM4E B2RXH2 1/20 0.37

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
SCHEMBL5432319 0.71 GRM1 (0.42) GRM1GRM5
SCHEMBL22488037 0.68 HPGD (0.39) XDHHCAR1GRM1KDM4E
SCHEMBL5429761 0.68 POLB (0.47) XDHGRM1GRM5
SCHEMBL7987439 0.67 CNOT7 (0.43) MEN1KMT2ASMN1; SMN2LMNAKDM4E
SCHEMBL22487747 0.67 XDH (0.42) SMN1; SMN2LMNAXDHHCAR1GRM1
SCHEMBL22487919 0.66 GRM1 (0.35) XDHHCAR1GRM1GRM5KDM4E
SCHEMBL22487927 0.66 GSK3B (0.41) XDHHCAR1GRM1GRM5
SCHEMBL4370028 0.64 ADORA1 (0.41)
SCHEMBL5437225 0.64 SMN1; SMN2 (0.48) MEN1NPC1RAB9AKMT2ASMN1; SMN2
SCHEMBL1993929 0.63 ADORA2A (0.40) RAB9ASMN1; SMN2LMNAXDHKDM4E

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-20070135454-A1 Bicyclic pyrimidin-4(3h)-ones and analogues and derivatives thereof which modulate the function of the vanilloid-1-receptor(vr1) BAYLISS TRACY 2007-06-14 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-20070135454-A1 Bicyclic pyrimidin-4(3h)-ones and analogues and derivatives thereof which modulate the function of the vanilloid-1-receptor(vr1) TRPV1, TRPV2, TRPV4 MEN1 4674/4885NPC1 1077/4885RAB9A 2806/4885

“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.