SCHEMBL5437287

SCHEMBL5437287

O=c1c2ncn(C3CC3)c2nc(SCCc2ccc(Cl)cc2Cl)n1-c1ccc(F)cc1

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.37
MEN1 O00255 2/20 0.37
NPSR1 Q6W5P4 1/20 0.36
USP7 Q93009 1/20 0.36
MAT2A P31153 1/20 0.35
CNR1 P21554 2/20 0.35
ALDH1A2 O94788 1/20 0.35
ALDH1A3 P47895 1/20 0.35
FADS1 O60427 1/20 0.35
CHKA P35790 1/20 0.34
MAOA P21397 1/20 0.33
MAOB P27338 1/20 0.33
LMNA P02545 2/20 0.33
TSHR P16473 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
TP53 P04637 1/20 0.33

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
SCHEMBL5432866 0.95 CNR1 (0.39) KMT2ACNR1ALDH1A2ALDH1A3MAOA
SCHEMBL5768190 0.86 FADS1 (0.36) KMT2ANPSR1USP7MAT2ACNR1
SCHEMBL5438803 0.86 KMT2A (0.40) KMT2AMEN1NPSR1CNR1ALDH1A2
SCHEMBL5437043 0.84 MAT2A (0.42) KMT2AMEN1NPSR1USP7MAT2A
SCHEMBL5431222 0.84 MAOB (0.34) CNR1ALDH1A2ALDH1A3MAOAMAOB
SCHEMBL5437261 0.83 MAOB (0.35) KMT2AMEN1NPSR1MAOAMAOB
SCHEMBL5431528 0.83 ALDH1A2 (0.34) CNR1ALDH1A2ALDH1A3MAOAMAOB
SCHEMBL5429578 0.80 NPSR1 (0.39) KMT2AMEN1NPSR1ALDH1A2ALDH1A3
SCHEMBL5438225 0.80 MAOB (0.41) KMT2AALDH1A2ALDH1A3MAOAMAOB
SCHEMBL5435969 0.80 MEN1 (0.35) KMT2AMEN1CHKAMAOB

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-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 claimed
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 KMT2A 4422/4885MEN1 4674/4885NPSR1 236/4885

“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.