SCHEMBL22199810

SCHEMBL22199810

c1ccc2c(-c3ccc(-c4nc(-c5ccc(-c6cccc7ccccc67)cc5)nc(-n5c6ccccc6c6c7ccccc7c7c8ccccc8oc7c65)n4)cc3)cccc2c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ENPP3 O14638 1/20 0.34
ENPP1 P22413 1/20 0.34
MAPT P10636 8/20 0.34
ALDH1A1 P00352 6/20 0.34
KDM4E B2RXH2 5/20 0.34
HPGD P15428 5/20 0.34
HSD17B10 Q99714 4/20 0.34
MAPK1 P28482 3/20 0.34
TSHR P16473 3/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
TP53 P04637 1/20 0.34
NFKB1 P19838 1/20 0.34
NFKB2 Q00653 1/20 0.34
RELA Q04206 1/20 0.34
ATM Q13315 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
HDAC8 Q9BY41 1/20 0.33
HDAC6 Q9UBN7 1/20 0.33
LMNA P02545 3/20 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
SCHEMBL22199809 0.88 MAPT (0.39) MAPTALDH1A1KDM4EHPGDHSD17B10
SCHEMBL22199932 0.88 MAPT (0.39) MAPTALDH1A1KDM4EHPGDHSD17B10
SCHEMBL17427569 0.87 MAPT (0.40) MAPTALDH1A1KDM4EHPGDHSD17B10
SCHEMBL18086401 0.87 KDM4E (0.32) MAPTALDH1A1KDM4EHPGDHSD17B10
SCHEMBL22199873 0.87 ALDH1A1 (0.36) ENPP3ENPP1MAPTALDH1A1KDM4E
SCHEMBL17427576 0.86 ENPP3 (0.34) ENPP3ENPP1MAPTALDH1A1KDM4E
SCHEMBL22199812 0.85 ALDH1A1 (0.37) MAPTALDH1A1KDM4EHPGDHSD17B10
SCHEMBL22200027 0.85 TDP1 (0.31) ENPP3ENPP1TDP1L3MBTL1
SCHEMBL22199913 0.85 MAPT (0.36) MAPTALDH1A1KDM4EHPGDHSD17B10
SCHEMBL22199933 0.84 ALDH1A1 (0.36) MAPTALDH1A1KDM4EHPGDHSD17B10

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-20200216392-A1 A PLURALITY OF HOST MATERIALS AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME DUPONT SPECIALTY MATERIALS KOREA LTD. (KR) 2020-07-09 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-20200216392-A1 A PLURALITY OF HOST MATERIALS AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME TERF2, PIEZO1, TERT ENPP3 592/4885ENPP1 211/4885MAPT 2914/4885

“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.