SCHEMBL12840441

SCHEMBL12840441

COc1ccc(-c2cnc(NC(=O)CCc3ccccc3)c(Cc3ccccc3)n2)cc1

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.47
MAPK1 P28482 1/20 0.47
RAB9A P51151 3/20 0.47
NPC1 O15118 2/20 0.46
PRKDC P78527 1/20 0.46
ATR Q13535 1/20 0.46
TSHR P16473 1/20 0.46
HSD17B1 P14061 1/20 0.45
ALOX5 P09917 1/20 0.44
SENP1 Q9P0U3 1/20 0.44
ADORA3 P0DMS8 1/20 0.44
ROCK2 O75116 1/20 0.44
ALPL P05186 1/20 0.44
CDK8 P49336 1/20 0.44
GAA P10253 1/20 0.43
KDR P35968 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43

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
SCHEMBL12840468 0.94 ALDH1A1 (0.50) RAB9ANPC1PRKDCATRADORA3
SCHEMBL12838932 0.93 MAPK1 (0.48) MAPTMAPK1RAB9ANPC1PRKDC
SCHEMBL12838961 0.92 MAPT (0.47) MAPTMAPK1RAB9ANPC1PRKDC
SCHEMBL12840072 0.91 MAPT (0.46) MAPTMAPK1RAB9ANPC1PRKDC
SCHEMBL1354211 0.90 ALDH1A1 (0.53) MAPTRAB9ANPC1PRKDCATR
SCHEMBL1356482 0.89 APP (0.54) MAPTRAB9ANPC1PRKDCATR
SCHEMBL12840048 0.88 MAPT (0.48) MAPTMAPK1RAB9ANPC1PRKDC
SCHEMBL1354165 0.87 PRKDC (0.49) MAPTMAPK1RAB9APRKDCATR
SCHEMBL12839461 0.87 HCAR2 (0.51) MAPTMAPK1PRKDCATRTSHR
SCHEMBL12840486 0.87 MAPK1 (0.52) MAPTMAPK1RAB9ANPC1PRKDC

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 MAPT 3847/4885MAPK1 4830/4885RAB9A 2980/4885

“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.