SCHEMBL20090138

SCHEMBL20090138

O=P(c1ccccc1)(c1ccccc1)c1ccc(-c2ccc(-c3ccc4nc5c6c7ccccc7ccc6c6cc7ccccc7cc6n5c4c3)cc2)cc1

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PTGES O14684 2/20 0.33
ALDH1A1 P00352 3/20 0.33
HPGD P15428 2/20 0.33
KDM4E B2RXH2 2/20 0.33
AHR P35869 1/20 0.33
KMT2A Q03164 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
NPM1 P06748 1/20 0.32
ALK Q9UM73 1/20 0.32
TYMS P04818 2/20 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
SCHEMBL19960093 0.95 AHR (0.34) PTGESKDM4EAHRKMT2ATYMS
SCHEMBL20090193 0.93 UTRN (0.32) PTGESALDH1A1HPGDKDM4EAHR
SCHEMBL19929016 0.92 ALDH1A1 (0.36) PTGESALDH1A1HPGDKDM4EAHR
SCHEMBL20090109 0.91 PTGES (0.33) PTGES
SCHEMBL20090078 0.91 METAP2 (0.31) NPM1ALK
SCHEMBL14644211 0.89 ALDH1A1 (0.41) PTGESALDH1A1HPGDKDM4EKMT2A
SCHEMBL20090127 0.89 ALDH1A1 (0.41) PTGESALDH1A1HPGDKDM4EKMT2A
SCHEMBL20090223 0.89 HPGD (0.34) PTGESALDH1A1HPGDKDM4EKMT2A
SCHEMBL20276038 0.89 AHR (0.36) PTGESALDH1A1HPGDKDM4EAHR
SCHEMBL19960198 0.89 ALDH1A1 (0.38) PTGESALDH1A1HPGDKDM4EKMT2A

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10355225-B2 Heterocyclic compound and organic light emitting element comprising same LG CHEM, LTD. (KR) 2019-07-16 US disclosed
US-20180114923-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING ELEMENT COMPRISING SAME LG CHEM, LTD. (KR) 2018-04-26 US disclosed
US-20180114923-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING ELEMENT COMPRISING SAME LG CHEM, LTD. (KR) 2018-04-26 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 (2 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-20180114923-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING ELEMENT COMPRISING SAME CRY1, CRY2, PER2 PTGES 1252/4885ALDH1A1 750/4885HPGD 2982/4885
US-10355225-B2 Heterocyclic compound and organic light emitting element comprising same CRY1, CRY2, PER2 PTGES 1252/4885ALDH1A1 750/4885HPGD 2982/4885

“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.