SCHEMBL5432508

SCHEMBL5432508

CCn1cnc2c(=O)n(-c3ccc(N(C)C)cc3)c(SCc3csc4ccc(Cl)cc34)nc21

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 2/20 0.36
ALDH1A2 O94788 2/20 0.36
ALDH1A3 P47895 2/20 0.36
UBE2M P61081 1/20 0.35
DCUN1D1 Q96GG9 1/20 0.35
ABCB1 P08183 1/20 0.34
ALDH1A1 P00352 1/20 0.33
HTR6 P50406 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
SCHEMBL5429211 0.94 ALDH1A2 (0.41) KDM1AALDH1A2ALDH1A3ABCB1
SCHEMBL5438338 0.91 KDM1A (0.39) KDM1AALDH1A2ALDH1A3ABCB1
SCHEMBL5437168 0.91 PTGS2 (0.39) KDM1AALDH1A2ALDH1A3ABCB1ALDH1A1
SCHEMBL5770177 0.88 KDM1A (0.36) KDM1AUBE2MDCUN1D1ABCB1
SCHEMBL5441947 0.87 ALDH1A2 (0.41) KDM1AALDH1A2ALDH1A3ALDH1A1
SCHEMBL5426588 0.83 ALDH1A2 (0.43) KDM1AALDH1A2ALDH1A3ABCB1ALDH1A1
SCHEMBL5440485 0.83 ALDH1A2 (0.39) KDM1AALDH1A2ALDH1A3ALDH1A1
SCHEMBL5435811 0.81 ALDH1A2 (0.40) KDM1AALDH1A2ALDH1A3ABCB1HTR6
SCHEMBL5434800 0.80 ALDH1A2 (0.40) KDM1AALDH1A2ALDH1A3UBE2MDCUN1D1
SCHEMBL5426946 0.80 MAPT (0.36)

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 KDM1A 4060/4885ALDH1A2 1259/4885ALDH1A3 1534/4885

“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.