SCHEMBL13629762

SCHEMBL13629762

OCc1ccc2c(c1)c1ccccc1n2-c1ccc(N(c2ccc(-n3c4ccccc4c4ccccc43)cc2)c2ccc(-n3c4ccccc4c4cc(CO)ccc43)cc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.44
L3MBTL1 Q9Y468 2/20 0.44
ATM Q13315 1/20 0.44
PGR P06401 1/20 0.44
LMNA P02545 2/20 0.41
MAPK1 P28482 2/20 0.41
POLB P06746 2/20 0.41
PTPN1 P18031 2/20 0.39
MAPT P10636 5/20 0.36
TP53 P04637 3/20 0.36
ALDH1A1 P00352 2/20 0.36
KMT2A Q03164 2/20 0.36
PLA2G4A P47712 1/20 0.36
F2 P00734 1/20 0.35
F10 P00742 1/20 0.35
PRSS1 P07477 1/20 0.35
NPY5R Q15761 3/20 0.35
MEN1 O00255 1/20 0.35
HPGD P15428 1/20 0.35
HTT P42858 1/20 0.35

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
SCHEMBL10063570 1.00 KDM4E (0.44) KDM4EL3MBTL1ATMPGRLMNA
SCHEMBL20664591 0.87 KDM4E (0.41) KDM4EL3MBTL1ATMPGRLMNA
SCHEMBL3787566 0.86 KDM4E (0.48) KDM4EL3MBTL1ATMPGRLMNA
SCHEMBL1201083 0.86 KDM4E (0.48) KDM4EL3MBTL1ATMPGRLMNA
SCHEMBL23126776 0.85 KDM4E (0.46) KDM4EL3MBTL1ATMPGRLMNA
SCHEMBL15306472 0.83 PGR (0.38) KDM4EL3MBTL1ATMPGRLMNA
SCHEMBL13629284 0.83 RORA (0.45) KDM4EL3MBTL1ATMPGRLMNA
SCHEMBL31419534 0.83 KDM4E (0.53) KDM4EL3MBTL1ATMPGRLMNA
SCHEMBL3810170 0.83 KDM4E (0.53) KDM4EL3MBTL1ATMPGRLMNA
SCHEMBL29435321 0.82 KDM4E (0.64) KDM4EL3MBTL1ATMPGRMAPK1

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-8343636-B2 Crosslinkable hole-transporting materials for organic light-emitting devices UNIVERSITY OF WASHINGTON (US) 2013-01-01 US disclosed
US-20090278445-A1 CROSSLINKABLE HOLE-TRANSPORTING MATERIALS FOR ORGANIC LIGHT-EMITTING DEVICES WASHINGTON, UNIVERSITY OF (US) 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-20090278445-A1 CROSSLINKABLE HOLE-TRANSPORTING MATERIALS FOR ORGANIC LIGHT-EMITTING DEVICES SUN2, HTT, SLC29A1 KDM4E 3636/4885L3MBTL1 714/4885ATM 2875/4885

“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.