SCHEMBL13959699

SCHEMBL13959699

c1ccc2c(c1)Cc1cccc3cncc-2c13

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.46
ALDH1A1 P00352 5/20 0.46
HPGD P15428 4/20 0.46
TSHR P16473 4/20 0.45
CYP3A4 P08684 3/20 0.45
MAPK8 P45983 2/20 0.42
MAPK9 P45984 2/20 0.42
MAPK10 P53779 1/20 0.42
HSD17B10 Q99714 5/20 0.41
MAPT P10636 3/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
CYP2C19 P33261 3/20 0.41
MAPK1 P28482 3/20 0.41
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
MEN1 O00255 2/20 0.41
TP53 P04637 2/20 0.41
CYP2D6 P10635 2/20 0.41
CYP2C9 P11712 2/20 0.41
PKM P14618 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
SCHEMBL11064693 0.89 ALDH1A1 (0.42) KDM4EALDH1A1HPGDTSHRCYP3A4
SCHEMBL29573523 0.81 TSHR (0.62) KDM4EALDH1A1HPGDTSHRCYP3A4
SCHEMBL3766146 0.81 TSHR (0.62) KDM4EALDH1A1HPGDTSHRCYP3A4
SCHEMBL13959695 0.77 ALDH1A1 (0.49) KDM4EALDH1A1HPGDTSHRCYP3A4
SCHEMBL11213974 0.77 ALDH1A1 (0.61) KDM4EALDH1A1HPGDTSHRCYP3A4
Fluorene SCHEMBL7752293 0.75 TSHR (0.54) KDM4EALDH1A1HPGDTSHRCYP3A4
Fluorene SCHEMBL28556215 0.75 TSHR (0.54) KDM4EALDH1A1HPGDTSHRCYP3A4
SCHEMBL13959692 0.75 MAPK8 (0.37) KDM4EALDH1A1HPGDTSHRCYP3A4
Pyrene SCHEMBL2125072 0.74 TSHR (0.65) KDM4EALDH1A1HPGDTSHRCYP3A4
Fluorene SCHEMBL28767808 0.74 TNF (0.44) KDM4EALDH1A1HPGDTSHRCYP3A4

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-20090004485-A1 6-MEMBER RING STRUCTURE USED IN ELECTROLUMINESCENT DEVICES GLOBAL OLED TECHNOLOGY LLC 2009-01-01 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-20090004485-A1 6-MEMBER RING STRUCTURE USED IN ELECTROLUMINESCENT DEVICES SOD1, SCO2, SOD3 KDM4E 1903/4885ALDH1A1 2970/4885HPGD 3829/4885

“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.