SCHEMBL19978058

SCHEMBL19978058

c1ccc2c(c1)c1cccc3c4ccccc4c4ccc2n4c13

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.47
MAPT P10636 4/20 0.47
ALDH1A1 P00352 3/20 0.47
HPGD P15428 3/20 0.47
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47
POLB P06746 2/20 0.47
HTT P42858 2/20 0.47
ALKBH5 Q6P6C2 1/20 0.43
FTO Q9C0B1 1/20 0.43
GPR3 P46089 1/20 0.40
CYP1A2 P05177 2/20 0.39
CYP2C19 P33261 1/20 0.39
L3MBTL1 Q9Y468 2/20 0.37
ATM Q13315 1/20 0.37
HSD17B10 Q99714 2/20 0.35
THRB P10828 1/20 0.35
LMNA P02545 1/20 0.34
DUSP3 P51452 1/20 0.34
CYP19A1 P11511 1/20 0.33

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
SCHEMBL21453813 0.95 MAPT (0.52) KDM4EMAPTALDH1A1HPGDMEN1
SCHEMBL29600269 0.92 KDM4E (0.53) KDM4EMAPTALDH1A1HPGDMEN1
SCHEMBL867663 0.92 KDM4E (0.53) KDM4EMAPTALDH1A1HPGDMEN1
SCHEMBL19541231 0.90 KDM4E (0.52) KDM4EMAPTALDH1A1HPGDMEN1
SCHEMBL24434226 0.86 KDM4E (0.46) KDM4EMAPTALDH1A1HPGDMEN1
SCHEMBL20857975 0.85 KDM4E (0.42) KDM4EMAPTALDH1A1HPGDMEN1
SCHEMBL24034725 0.84 ALKBH5 (0.48) KDM4EMAPTALDH1A1HPGDMEN1
SCHEMBL15434837 0.84 ALKBH5 (0.48) KDM4EMAPTALDH1A1HPGDMEN1
SCHEMBL20857813 0.84 KDM4E (0.52) KDM4EMAPTALDH1A1HPGDMEN1
SCHEMBL20857804 0.83 KDM4E (0.47) KDM4EMAPTALDH1A1HPGDMEN1

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-20180083203-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION 2018-03-22 US disclosed
US-20180083203-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION 2018-03-22 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-20180083203-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES NES, CACNA2D4, PGLS KDM4E 2755/4885MAPT 451/4885ALDH1A1 3925/4885

“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.