SCHEMBL761808

SCHEMBL761808

c1ccc(N(c2ccc3c(c2)-c2cccc4c(-c5c6ccccc6c6c7c(cccc57)-c5cc(-c7ccccn7)ccc5-6)ccc-3c24)c2cccc3ccccc23)cc1

nearest known ligand 0.32

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 1/20 0.32
DHODH Q02127 1/20 0.32
TGFBR1 P36897 1/20 0.31
KDM4E B2RXH2 1/20 0.31
NPC1 O15118 1/20 0.31
ALDH1A1 P00352 1/20 0.31
TP53 P04637 1/20 0.31
MAPT P10636 1/20 0.31
HPGD P15428 1/20 0.31
MAPK1 P28482 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
HSD17B10 Q99714 1/20 0.31
PDK2 Q15119 1/20 0.30

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
SCHEMBL762745 0.88 ALDH1A1 (0.35) ALDH1A1HPGDMAPK1HSD17B10
SCHEMBL762746 0.82 DHODH (0.38) HTR2CDHODHTGFBR1KDM4ENPC1
SCHEMBL17465783 0.78 KDM4E (0.41) HTR2CDHODHTGFBR1KDM4ENPC1
SCHEMBL12014716 0.78 ALDH1A1 (0.38) ALDH1A1HPGDMAPK1HSD17B10
SCHEMBL15158406 0.77 HTR2C (0.41) HTR2CDHODHTGFBR1KDM4ENPC1
SCHEMBL15158450 0.77 KDM4E (0.41) HTR2CDHODHTGFBR1KDM4ENPC1
SCHEMBL15158508 0.77 KDM4E (0.41) HTR2CDHODHTGFBR1KDM4ENPC1
SCHEMBL15178585 0.77 HTR2C (0.39) HTR2CDHODHTGFBR1KDM4ENPC1
SCHEMBL16485340 0.76 PDK2 (0.38) HTR2CDHODHTGFBR1NPC1HPGD
SCHEMBL762280 0.76 PDK2 (0.35) HTR2CDHODHTGFBR1KDM4ENPC1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8138668-B2 Benzo[a]fluoranthene compound and organic light emitting device using the same CANON KABUSHIKI KAISHA (JP) 2012-03-20 US disclosed
US-8138668-B2 Benzo[a]fluoranthene compound and organic light emitting device using the same CANON KABUSHIKI KAISHA (JP) 2012-03-20 US disclosed
US-20100019661-A1 BENZO[a]FLUORANTHENE COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING THE SAME CANON KABUSHIKI KAISHA (JP) 2010-01-28 US disclosed
US-20100019661-A1 BENZO[a]FLUORANTHENE COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING THE SAME CANON KABUSHIKI KAISHA (JP) 2010-01-28 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-20100019661-A1 BENZO[a]FLUORANTHENE COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING THE SAME AFF1, AFF2, CYP1A1 HTR2C 2444/4885DHODH 1822/4885TGFBR1 1071/4885

“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.