SCHEMBL13264609

SCHEMBL13264609

BN(Cc1ccc2c(c1)OCCO2)C1CCN(CCn2c(=O)cc(C(=O)NC3CCCC3)c3ccc(OC)cc32)CC1

nearest known ligand 0.51

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 3/20 0.51
CNR1 P21554 2/20 0.51
KCNH2 Q12809 6/20 0.47
MCHR1 Q99705 12/20 0.44
MAPT P10636 1/20 0.42

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
SCHEMBL13264442 0.91 KCNH2 (0.45) CNR2CNR1KCNH2MCHR1MAPT
SCHEMBL5040949 0.88 KCNH2 (0.49) CNR2CNR1KCNH2MCHR1
SCHEMBL12002166 0.88 CNR2 (0.47) CNR2CNR1KCNH2MCHR1MAPT
SCHEMBL12002326 0.88 KCNH2 (0.58) CNR2CNR1KCNH2MCHR1
SCHEMBL2798529 0.86 KCNH2 (0.45) CNR2CNR1KCNH2MCHR1
SCHEMBL12002139 0.85 KCNH2 (0.59) CNR2KCNH2MCHR1
SCHEMBL13264481 0.85 KCNH2 (0.46) CNR2KCNH2MCHR1MAPT
SCHEMBL12002254 0.85 KCNH2 (0.43) KCNH2MCHR1
SCHEMBL2793456 0.85 KCNH2 (0.59) CNR2CNR1KCNH2MCHR1
SCHEMBL13264491 0.84 KCNH2 (0.42) KCNH2MCHR1

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-8329694-B2 Quinoxalinones as antibacterial composition TOYAMA CHEMICAL CO., LTD. (JP) 2012-12-11 US disclosed
US-20100168418-A1 NOVEL NITROGENATED HETEROCYCLIC COMPOUND AND SALT THEREOF TOYAMA CHEMICAL CO., LTD. (JP) 2010-07-01 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-20100168418-A1 NOVEL NITROGENATED HETEROCYCLIC COMPOUND AND SALT THEREOF ROS1, NOX1, ARG1 CNR2 807/4885CNR1 673/4885KCNH2 578/4885

“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.