SCHEMBL2201454

SCHEMBL2201454

c1ccc2cc3c(cc2c1)-c1cccc2c(-c4ccc5c(c4)-c4cccc6cccc-5c46)ccc-3c12

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.62
HSD17B10 Q99714 4/20 0.62
MAPK1 P28482 4/20 0.62
TSHR P16473 3/20 0.62
CASP1 P29466 3/20 0.62
HPGD P15428 3/20 0.62
HIF1A Q16665 2/20 0.62
CASP7 P55210 2/20 0.62
TP53 P04637 1/20 0.62
L3MBTL1 Q9Y468 3/20 0.55
ATM Q13315 3/20 0.52
PABPC1 P11940 3/20 0.43
CYP3A4 P08684 1/20 0.43
DNMT1 P26358 1/20 0.43
CRHBP P24387 1/20 0.43
CRHR2 Q13324 1/20 0.43
KEAP1 Q14145 1/20 0.43
NFE2L2 Q16236 1/20 0.43
MCL1 Q07820 2/20 0.39
ACMSD Q8TDX5 1/20 0.39

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
SCHEMBL3778868 0.86 ALDH1A1 (0.57) ALDH1A1HSD17B10MAPK1TSHRCASP1
SCHEMBL8010799 0.83 ALDH1A1 (0.67) ALDH1A1HSD17B10MAPK1TSHRCASP1
SCHEMBL25670029 0.82 ALDH1A1 (0.46) ALDH1A1HSD17B10MAPK1TSHRCASP1
SCHEMBL12367185 0.81 ALDH1A1 (0.40) ALDH1A1HSD17B10MAPK1TSHRCASP1
SCHEMBL18045745 0.81 L3MBTL1 (0.55) ALDH1A1HSD17B10MAPK1TSHRCASP1
SCHEMBL25596040 0.80 ALDH1A1 (0.42) ALDH1A1HSD17B10MAPK1TSHRCASP1
SCHEMBL20698541 0.80 ALDH1A1 (0.47) ALDH1A1HSD17B10MAPK1TSHRCASP1
SCHEMBL12367181 0.79 TGFBR1 (0.38) ALDH1A1HSD17B10MAPK1TSHRCASP1
SCHEMBL12367183 0.79 ALDH1A1 (0.38) ALDH1A1HSD17B10MAPK1TSHRCASP1
Benzo(K)Fluoranthene SCHEMBL29393074 0.79 ALDH1A1 (1.00) ALDH1A1HSD17B10MAPK1TSHRCASP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7977869-B2 Organic luminescent device and benzo[k]fluoranthene compound CANON KABUSHIKI KAISHA (JP) 2011-07-12 US disclosed
US-20090278447-A1 ORGANIC LUMINESCENT DEVICE AND BENZO[k]FLUORANTHENE COMPOUND CANON KABUSHIKI KAISHA (JP) 2009-11-12 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-20090278447-A1 ORGANIC LUMINESCENT DEVICE AND BENZO[k]FLUORANTHENE COMPOUND FOXK1, KCNK10, F10 ALDH1A1 1170/4885HSD17B10 1809/4885MAPK1 1803/4885

“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.