SCHEMBL19655164

SCHEMBL19655164

c1ccc(-n2c3ccccc3c3ccc4c5ccccc5n(-c5nc6ccccc6nc5-c5ccc6oc7ccccc7c6c5)c4c32)cc1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SIRT2 Q8IXJ6 1/20 0.35
SIRT1 Q96EB6 1/20 0.35
CHEK2 O96017 1/20 0.35
KDM4E B2RXH2 3/20 0.35
L3MBTL1 Q9Y468 2/20 0.35
ATM Q13315 1/20 0.35
PRKACA P17612 1/20 0.32
RPS6KB1 P23443 1/20 0.32
GSK3B P49841 1/20 0.32
ROCK1 Q13464 1/20 0.32
CASP1 P29466 1/20 0.32
HSD17B10 Q99714 1/20 0.32
NPC1 O15118 2/20 0.32
RAB9A P51151 2/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
ALDH1A1 P00352 2/20 0.32
HPGD P15428 2/20 0.32
MEN1 O00255 1/20 0.32
MAPT P10636 1/20 0.32
KMT2A Q03164 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
SCHEMBL19655228 0.89 KDM4E (0.34) SIRT2SIRT1CHEK2KDM4EL3MBTL1
SCHEMBL24104176 0.88 KDM4E (0.38) SIRT2SIRT1CHEK2KDM4EL3MBTL1
SCHEMBL21454969 0.87 KDM4E (0.37) SIRT2SIRT1CHEK2KDM4EL3MBTL1
SCHEMBL19655184 0.86 HSD17B10 (0.37) KDM4EL3MBTL1CASP1HSD17B10NPC1
SCHEMBL19655130 0.86 CHEK2 (0.33) CHEK2MERTK
SCHEMBL19653888 0.85 SIRT2 (0.35) SIRT2SIRT1CHEK2KDM4EL3MBTL1
SCHEMBL21942051 0.84 KDM4E (0.37) SIRT2SIRT1CHEK2KDM4EL3MBTL1
SCHEMBL19655277 0.84 KDM4E (0.38) SIRT2SIRT1KDM4EL3MBTL1ATM
SCHEMBL24848686 0.84 SIRT2 (0.33) SIRT2SIRT1CHEK2KDM4EL3MBTL1
SCHEMBL19655161 0.84 L3MBTL1 (0.39) KDM4EL3MBTL1ATMCASP1HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10840458-B2 Organic electroluminescent materials and devices UNIVERSAL DISPLAY CORPORATION (US) 2020-11-17 US disclosed
US-20170346022-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION (US) 2017-11-30 US disclosed
US-20170346022-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION (US) 2017-11-30 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 (2 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-20170346022-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES PDXK, MT-ND4L, PNPO SIRT2 2200/4885SIRT1 2303/4885CHEK2 2069/4885
US-10840458-B2 Organic electroluminescent materials and devices PDXK, MT-ND4L, PNPO SIRT2 2200/4885SIRT1 2303/4885CHEK2 2069/4885

“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.