SCHEMBL21362344

SCHEMBL21362344

Ic1cc(N(c2ccccc2)c2ccccn2)cc2c1oc1ccccc12

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AHR P35869 1/20 0.34
NPC1 O15118 4/20 0.33
MAPT P10636 3/20 0.33
LMNA P02545 3/20 0.33
RAB9A P51151 3/20 0.33
KMT2A Q03164 2/20 0.33
HTT P42858 2/20 0.33
MEN1 O00255 1/20 0.33
USP2 O75604 1/20 0.33
ALDH1A1 P00352 3/20 0.32
HDAC6 Q9UBN7 2/20 0.31
DRD4 P21917 1/20 0.31
ALOX5 P09917 2/20 0.31
SMN1; SMN2 Q16637 4/20 0.31
KDM4E B2RXH2 2/20 0.31
HPGD P15428 1/20 0.30
TSHR P16473 2/20 0.30
MAPK1 P28482 1/20 0.30
LIMK1 P53667 1/20 0.30
TP53 P04637 1/20 0.30

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
SCHEMBL21352474 0.81 MAPT (0.46) AHRNPC1MAPTLMNARAB9A
SCHEMBL30843228 0.81 MAPT (0.46) AHRNPC1MAPTLMNARAB9A
SCHEMBL4647647 0.72 ALDH1A1 (0.45) MAPTLMNAUSP2ALDH1A1HDAC6
SCHEMBL16804576 0.70 MAPT (0.37) NPC1MAPTLMNAKMT2AMEN1
SCHEMBL21936763 0.70 AHR (0.42) AHRNPC1MAPTRAB9AKMT2A
SCHEMBL10144439 0.70 HDAC6 (0.47) MAPTLMNAUSP2ALDH1A1HDAC6
SCHEMBL29312638 0.70 ALOX5 (0.51) AHRNPC1MAPTRAB9AKMT2A
SCHEMBL13608526 0.69 HDAC6 (0.40) MAPTLMNAUSP2ALDH1A1HDAC6
SCHEMBL22860975 0.69 JAK2 (0.33) NPC1MAPTLMNARAB9AKMT2A
SCHEMBL14134094 0.69 ALOX5 (0.32) NPC1MAPTLMNARAB9AKMT2A

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-20190288223-A1 ORGANOMETALLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2019-09-19 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-20190288223-A1 ORGANOMETALLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME TPO, RPLP0, RPS10 AHR 840/4885NPC1 4210/4885MAPT 463/4885

“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.