SCHEMBL21419782

SCHEMBL21419782

O=C(c1ccccc1)c1ccc(-c2ccc(N3c4ccccc4Sc4ccccc43)cc2)cc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 1/20 0.62
BCHE P06276 8/20 0.51
ACHE P22303 3/20 0.51
LMNA P02545 5/20 0.49
MAPT P10636 4/20 0.49
RAB9A P51151 2/20 0.49
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
NOX1 Q9Y5S8 3/20 0.44
L3MBTL1 Q9Y468 2/20 0.44
TDP1 Q9NUW8 2/20 0.44
MAPK1 P28482 1/20 0.44
ALDH1A1 P00352 2/20 0.44
HPGD P15428 2/20 0.44
NPC1 O15118 1/20 0.44
TP53 P04637 1/20 0.44
ALOX15 P16050 1/20 0.44
TSHR P16473 1/20 0.44
STAT1 P42224 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44

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
SCHEMBL19268847 0.95 HDAC6 (0.68) HDAC6BCHEACHELMNAMAPT
SCHEMBL30874618 0.92 HDAC6 (0.71) HDAC6BCHEACHELMNAMAPT
SCHEMBL17851122 0.92 HDAC6 (0.71) HDAC6BCHEACHELMNAMAPT
SCHEMBL22146537 0.92 HDAC6 (0.71) HDAC6BCHEACHELMNAMAPT
SCHEMBL17124553 0.90 HDAC6 (0.52) HDAC6BCHEACHELMNAMAPT
SCHEMBL28545381 0.84 HDAC6 (0.69) HDAC6BCHEACHELMNAMAPT
SCHEMBL30436360 0.84 HDAC6 (0.54) HDAC6BCHEACHELMNAMEN1
SCHEMBL4243905 0.84 HDAC6 (0.54) HDAC6BCHEACHELMNAMEN1
SCHEMBL15470447 0.83 HDAC6 (0.57) HDAC6BCHEACHEMEN1KMT2A
SCHEMBL18388642 0.83 HDAC6 (0.45) HDAC6BCHEACHELMNAMAPT

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-20190305228-A1 ORGANIC LIGHTEMITTING COMPOUND HAVING PHOSPHORESCENT CHARACTERISTIC AT ROOM TEMPERATURE, AND PHOSPHORESCENT ORGANIC LIGHT EMITTING DEVICE INCLUDING THE ORGANIC LIGHTEMITTING COMPOUND RESEARCH & BUSINESS FOUNDATION SUNGKYUNKWAN UNIVER SITY (KR) 2019-10-03 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-20190305228-A1 ORGANIC LIGHTEMITTING COMPOUND HAVING PHOSPHORESCENT CHARACTERISTIC AT ROOM TEMPERATURE, AND PHOSPHORESCENT ORGANIC LIGHT EMITTING DEVICE INCLUDING THE ORGANIC LIGHTEMITTING COMPOUND MAP1LC3C, MAP1LC3A, MAP1LC3B HDAC6 4794/4885BCHE 4076/4885ACHE 2718/4885

“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.