SCHEMBL6359316

SCHEMBL6359316

O=C(Nc1ccc2cccnc2c1)c1cn(Cc2ccccc2)c2ccccc12

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 2/20 0.53
CNR1 P21554 1/20 0.52
SLC22A12 Q96S37 1/20 0.50
KLKB1 P03952 1/20 0.48
TRPV1 Q8NER1 2/20 0.48
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
L3MBTL1 Q9Y468 2/20 0.47
ADORA1 P30542 1/20 0.47
NR1I2 O75469 1/20 0.47
MAPK1 P28482 2/20 0.47
NPSR1 Q6W5P4 2/20 0.47
HTT P42858 1/20 0.47
ACLY P53396 1/20 0.46
POLB P06746 1/20 0.46
LMNA P02545 1/20 0.46
FSCN1 Q16658 1/20 0.46
HDAC1 Q13547 1/20 0.46
HDAC2 Q92769 1/20 0.46
TUBB4A P04350 1/20 0.46

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
SCHEMBL6359035 0.82 HTR2C (0.57) CNR2CNR1TRPV1MEN1KMT2A
SCHEMBL3880418 0.80 MEN1 (0.56) TRPV1MEN1KMT2ANR1I2POLB
SCHEMBL1606447 0.79 SLC22A12 (0.60) CNR2CNR1SLC22A12MEN1KMT2A
SCHEMBL6116808 0.77 CHRM1 (0.56) CNR2CNR1MEN1KMT2AL3MBTL1
SCHEMBL28575405 0.77 SENP7 (0.60) CNR2CNR1MEN1KMT2AL3MBTL1
SCHEMBL5346065 0.76 TUBB4A (0.68) CNR2MEN1KMT2AADORA1NPSR1
SCHEMBL29409455 0.76 TUBB4A (0.68) CNR2MEN1KMT2AADORA1NPSR1
SCHEMBL6116706 0.76 L3MBTL1 (0.54) CNR2CNR1MEN1KMT2AL3MBTL1
SCHEMBL5573795 0.75 TUBB4A (0.56) CNR2MEN1KMT2ANPSR1HTT
SCHEMBL18132530 0.74 MEN1 (0.61) TRPV1MEN1KMT2AL3MBTL1HTT

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050165049-A1 Vanilloid receptor ligands and their use in treatments AMGEN, INC. 2005-07-28 US claimed
US-7544803-B2 Vanilloid receptor ligands and their use in treatments AMGEN INC. (US) 2009-06-09 US disclosed
US-7544803-B2 Vanilloid receptor ligands and their use in treatments AMGEN INC. (US) 2009-06-09 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-20050165049-A1 Vanilloid receptor ligands and their use in treatments TRPV1, TRPV2, TRPV3 CNR2 171/4885CNR1 391/4885SLC22A12 2522/4885

“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.