SCHEMBL21965713

SCHEMBL21965713

c1ccc(-c2nc(-c3ccc4c(c3)c3ccccc3n4-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)nc(-c3ccc4c(c3)c3cccc5c6ccccc6n4c53)n2)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPY5R Q15761 2/20 0.36
MEN1 O00255 7/20 0.35
KMT2A Q03164 7/20 0.35
MAPT P10636 5/20 0.35
ALDH1A1 P00352 3/20 0.35
HPGD P15428 3/20 0.35
KDM4E B2RXH2 4/20 0.34
ATM Q13315 2/20 0.34
LMNA P02545 1/20 0.34
GLA P06280 1/20 0.34
PTGER4 P35408 2/20 0.34
L3MBTL1 Q9Y468 2/20 0.33
TSHR P16473 1/20 0.33
HSD17B10 Q99714 1/20 0.33
TSPO P30536 1/20 0.33
GAA P10253 1/20 0.33
POLB P06746 1/20 0.33
HTT P42858 1/20 0.33
ABCG2 Q9UNQ0 4/20 0.32
ABCB1 P08183 1/20 0.32

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
SCHEMBL17265064 0.97 NPY5R (0.36) NPY5RMEN1KMT2AMAPTALDH1A1
SCHEMBL21454099 0.96 NPY5R (0.35) NPY5RMEN1KMT2AMAPTALDH1A1
SCHEMBL21965712 0.95 NPY5R (0.36) NPY5RMEN1KMT2AMAPTALDH1A1
SCHEMBL17265076 0.94 NPY5R (0.34) NPY5RMEN1KMT2AMAPTALDH1A1
SCHEMBL25640781 0.94 MEN1 (0.34) NPY5RMEN1KMT2AMAPTALDH1A1
SCHEMBL25640775 0.93 KDM4E (0.35) NPY5RMEN1KMT2AMAPTALDH1A1
SCHEMBL25640773 0.93 KDM4E (0.35) NPY5RMEN1KMT2AMAPTALDH1A1
SCHEMBL11926481 0.93 MEN1 (0.39) NPY5RMEN1KMT2AMAPTALDH1A1
SCHEMBL17265053 0.92 NPY5R (0.36) NPY5RMEN1KMT2AMAPTALDH1A1
SCHEMBL25640767 0.92 KDM4E (0.34) NPY5RMEN1KMT2AMAPTALDH1A1

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-20200144512-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION (US) 2020-05-07 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-20200144512-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES GDA, SOD1, GALC NPY5R 3246/4885MEN1 3611/4885KMT2A 4198/4885

“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.