SCHEMBL12840580

SCHEMBL12840580

O=C(CCc1ccccc1)Nc1nc2c(nc1-c1ccc(O)cc1)-c1ccc(O)cc1CC2

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 14/20 0.48
CYP2C9 P11712 4/20 0.48
CYP2C8 P10632 3/20 0.48
TOP2A P11388 1/20 0.47
TOP2B Q02880 1/20 0.47
PLTP P55058 1/20 0.43
MAPK14 Q16539 1/20 0.41
LMNA P02545 1/20 0.41
ALOX15 P16050 1/20 0.40
MAPK1 P28482 1/20 0.40

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
SCHEMBL13068114 0.97 HCAR2 (0.49) HCAR2CYP2C9CYP2C8TOP2ATOP2B
SCHEMBL12840558 0.94 TRPV1 (0.47) HCAR2CYP2C9CYP2C8TOP2ATOP2B
SCHEMBL12838677 0.93 POLB (0.45) HCAR2CYP2C9CYP2C8TOP2ATOP2B
SCHEMBL12840708 0.93 HCAR2 (0.42) HCAR2CYP2C9CYP2C8TOP2ATOP2B
SCHEMBL12839353 0.92 HCAR2 (0.46) HCAR2CYP2C9CYP2C8TOP2ATOP2B
SCHEMBL12840554 0.91 HCAR2 (0.45) HCAR2CYP2C9CYP2C8TOP2ATOP2B
SCHEMBL12838700 0.90 RAB9A (0.44) HCAR2CYP2C9CYP2C8TOP2ATOP2B
SCHEMBL12840579 0.90 IKBKB (0.41) HCAR2CYP2C9CYP2C8MAPK14
SCHEMBL12840690 0.87 TRPV1 (0.43) HCAR2CYP2C9CYP2C8TOP2ATOP2B
SCHEMBL12838682 0.87 TRPV1 (0.43) HCAR2CYP2C9CYP2C8PLTPMAPK14

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 3839/4885CYP2C9 3809/4885CYP2C8 3743/4885

“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.