SCHEMBL22326550

SCHEMBL22326550

c1ccc(-c2ccc(-c3cc(-c4cccc5c4C4(c6ccccc6-c6ccccc64)c4oc6ccccc6c4-5)nc4ccccc34)cn2)cc1

nearest known ligand 0.36

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ACACA Q13085 6/20 0.36
HDAC6 Q9UBN7 1/20 0.35
MAPK1 P28482 2/20 0.34
KDM4E B2RXH2 2/20 0.34
ALDH1A1 P00352 2/20 0.34
HPGD P15428 2/20 0.34
L3MBTL1 Q9Y468 2/20 0.34
MAPT P10636 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
DHODH Q02127 6/20 0.33
TSHR P16473 1/20 0.32
HSD17B10 Q99714 1/20 0.32
GRM4 Q14833 1/20 0.32
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
LMNA P02545 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
PDE10A Q9Y233 1/20 0.31

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
SCHEMBL20174432 0.91 ACACA (0.39) ACACAMAPK1KDM4EALDH1A1HPGD
SCHEMBL20174311 0.83 MAPT (0.38) MAPK1KDM4EALDH1A1HPGDL3MBTL1
SCHEMBL20174437 0.81 ACACA (0.38) ACACAMAPK1KDM4EALDH1A1HPGD
SCHEMBL20174424 0.79 ACACA (0.38) ACACAMAPK1KDM4EALDH1A1HPGD
SCHEMBL20174396 0.78 KMT2A (0.35) MAPK1KDM4EALDH1A1HPGDL3MBTL1
SCHEMBL20174314 0.78 ALDH1A1 (0.36) MAPK1KDM4EALDH1A1HPGDL3MBTL1
SCHEMBL22326574 0.78 ENPP3 (0.34) MAPK1KDM4EALDH1A1HPGDL3MBTL1
SCHEMBL20174315 0.77 ENPP3 (0.35) ACACAMAPK1KDM4EALDH1A1HPGD
SCHEMBL20174724 0.77 PDK2 (0.33) ACACAMAPK1KDM4EALDH1A1HPGD
SCHEMBL20174390 0.77 CYP1A1 (0.40) ACACAMAPK1KDM4EALDH1A1HPGD

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-10738034-B2 Spiro compound and organic light-emitting device comprising same LG CHEM, LTD. (KR) 2020-08-11 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-10738034-B2 Spiro compound and organic light-emitting device comprising same CRY1, NR2E3, ERG ACACA 2815/4885HDAC6 2215/4885MAPK1 3742/4885

“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.