SCHEMBL12840708

SCHEMBL12840708

Nc1ccc2c(c1)CCc1nc(NC(=O)CCc3ccccc3)c(-c3ccc(O)cc3)nc1-2

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 13/20 0.42
TOP2A P11388 2/20 0.42
TOP2B Q02880 1/20 0.42
CYP2C9 P11712 3/20 0.42
CYP2C8 P10632 2/20 0.42
PLTP P55058 1/20 0.41
MAPK14 Q16539 2/20 0.39
LMNA P02545 1/20 0.39
PLAU P00749 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
SCHEMBL12840690 0.95 TRPV1 (0.43) HCAR2TOP2ATOP2BCYP2C9CYP2C8
SCHEMBL12840276 0.94 MAPK14 (0.41) HCAR2CYP2C9CYP2C8MAPK14LMNA
SCHEMBL12840580 0.93 HCAR2 (0.48) HCAR2TOP2ATOP2BCYP2C9CYP2C8
SCHEMBL12840640 0.91 TOP2A (0.41) HCAR2TOP2ACYP2C9CYP2C8MAPK14
SCHEMBL13068114 0.90 HCAR2 (0.49) HCAR2TOP2ATOP2BCYP2C9CYP2C8
SCHEMBL12838677 0.89 POLB (0.45) HCAR2TOP2ATOP2BCYP2C9CYP2C8
SCHEMBL12840306 0.89 HDAC1 (0.42) MAPK14
SCHEMBL12839353 0.89 HCAR2 (0.46) HCAR2TOP2ATOP2BCYP2C9CYP2C8
SCHEMBL12840558 0.87 TRPV1 (0.47) HCAR2TOP2ATOP2BCYP2C9CYP2C8
SCHEMBL13068338 0.87 CDK2 (0.41) HCAR2TOP2ACYP2C9CYP2C8MAPK14

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-20110070656-A1 Fluorescent Proteins JNC CORPORATION (JP) 2011-03-24 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-20110070656-A1 Fluorescent Proteins CACYBP, CHLSN, LCP2 HCAR2 3839/4885TOP2A 3075/4885TOP2B 2921/4885

“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.