SCHEMBL20090123

SCHEMBL20090123

O=P(c1ccccc1)(c1ccncc1)c1cnc2cc(-c3ccc4nc5c6c7ccccc7ccc6c6cc7ccccc7cc6n5c4c3)ccc2c1

nearest known ligand 0.32

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 1/20 0.32
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
MAPT P10636 1/20 0.32
HPGD P15428 1/20 0.32
MAPK10 P53779 1/20 0.31
METAP2 P50579 1/20 0.31
GAK O14976 1/20 0.30
NPM1 P06748 1/20 0.30
ALK Q9UM73 1/20 0.30
SMN1; SMN2 Q16637 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
SCHEMBL20090078 0.96 METAP2 (0.31) METAP2NPM1ALK
SCHEMBL20090126 0.91 KDM4E (0.32) KDM4EALDH1A1MAPTHPGD
SCHEMBL20090083 0.90
SCHEMBL20090138 0.87 PTGES (0.33) KDM4EALDH1A1HPGDNPM1ALK
SCHEMBL20090082 0.86 NPC1 (0.30) MAPTMETAP2SMN1; SMN2
SCHEMBL20090096 0.86 PTGES (0.31) METAP2
SCHEMBL20090229 0.84 MAPK8 (0.33) CYP2C9KDM4EALDH1A1MAPTHPGD
SCHEMBL20090109 0.84 PTGES (0.33)
SCHEMBL19960187 0.83 MAPT (0.32) CYP2C9KDM4EALDH1A1MAPTHPGD
SCHEMBL20090092 0.83 ALDH1A1 (0.34) CYP2C9KDM4EALDH1A1MAPTHPGD

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 CYP2C9 143/4885KDM4E 1997/4885ALDH1A1 750/4885
US-10355225-B2 Heterocyclic compound and organic light emitting element comprising same CRY1, CRY2, PER2 CYP2C9 143/4885KDM4E 1997/4885ALDH1A1 750/4885

“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.