SCHEMBL10070481

SCHEMBL10070481

Bc1ccccc1-c1nc2ccccc2n1-c1ccccc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RECQL P46063 1/20 0.62
MAPK1 P28482 1/20 0.56
HTT P42858 1/20 0.56
ESR2 Q92731 5/20 0.54
ESR1 P03372 4/20 0.54
RAB9A P51151 2/20 0.53
PRKACA P17612 1/20 0.50
RPS6KB1 P23443 1/20 0.50
GSK3B P49841 1/20 0.50
ROCK1 Q13464 1/20 0.50
GSR P00390 1/20 0.46
GRIA1 P42261 1/20 0.43
CACNG8 Q8WXS5 1/20 0.43
CACNG2 Q9Y698 1/20 0.43
TSHR P16473 2/20 0.42
KDM4E B2RXH2 2/20 0.42
ALDH1A1 P00352 2/20 0.42
HPGD P15428 1/20 0.42
CHRM2 P08172 2/20 0.41
CHRM4 P08173 2/20 0.41

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
SCHEMBL13085156 0.88 RECQL (0.71) RECQLMAPK1HTTESR2ESR1
SCHEMBL3473850 0.86 RECQL (0.69) RECQLMAPK1HTTESR2ESR1
SCHEMBL12854005 0.86 RECQL (0.69) RECQLMAPK1HTTESR2ESR1
SCHEMBL8010509 0.82 RECQL (0.64) RECQLMAPK1HTTESR2ESR1
SCHEMBL22522284 0.82 RECQL (0.64) RECQLMAPK1HTTESR2ESR1
SCHEMBL647306 0.82 RECQL (0.64) RECQLMAPK1HTTESR2ESR1
SCHEMBL6300348 0.81 RECQL (0.62) RECQLMAPK1HTTESR2ESR1
SCHEMBL356492 0.81 RECQL (0.62) RECQLMAPK1HTTESR2ESR1
SCHEMBL8021269 0.81 ESR1 (0.78) RECQLMAPK1HTTESR2ESR1
SCHEMBL29521808 0.81 RECQL (0.62) RECQLMAPK1HTTESR2ESR1

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-20120016449-A1 PHOTOTHERAPY DEVICES AND METHODS COMPRISING SUBSTITUTED CARBAZOLE COMPOUNDS NITTO DENKO CORPORATION (JP) 2012-01-19 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-20120016449-A1 PHOTOTHERAPY DEVICES AND METHODS COMPRISING SUBSTITUTED CARBAZOLE COMPOUNDS TYR, PPOX, CRY1 RECQL 683/4885MAPK1 1889/4885HTT 1661/4885

“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.