SCHEMBL20096520

SCHEMBL20096520

S=P(c1ccccc1)(c1ccncc1)c1ccc(-c2ccc3nc4c5c6ccccc6ccc5c5ccc(-c6cnc7cc(P(=S)(c8ccccc8)c8ccncc8)ccc7c6)cc5n4c3c2)nc1

nearest known ligand 0.32

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PDGFRB P09619 1/20 0.32
PDGFRA P16234 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
CYP11B1 P15538 1/20 0.31
CYP11B2 P19099 1/20 0.31
MAPK10 P53779 1/20 0.31
GAK O14976 1/20 0.30
PIK3CD O00329 1/20 0.30
PIK3CA P42336 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
SCHEMBL20090254 0.98 CYP11B1 (0.32) PDGFRBPDGFRAKDM4EALDH1A1MAPT
SCHEMBL20090250 0.96 PIK3CD (0.32) PIK3CDPIK3CA
SCHEMBL20096347 0.94 PDGFRB (0.32) PDGFRBPDGFRAKDM4EALDH1A1MAPT
SCHEMBL20090202 0.92 CYP11B1 (0.32) PDGFRBPDGFRAKDM4EALDH1A1MAPT
SCHEMBL20096638 0.92
SCHEMBL20096407 0.91
SCHEMBL20090195 0.90 PIK3CD (0.32) PIK3CDPIK3CA
SCHEMBL20090191 0.87 MTOR (0.31) PIK3CDPIK3CA
SCHEMBL20096352 0.85
SCHEMBL20090199 0.85 FTO (0.31) CYP11B1CYP11B2PIK3CD

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-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 (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-20180114923-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING ELEMENT COMPRISING SAME CRY1, CRY2, PER2 PDGFRB 3067/4885PDGFRA 2350/4885KDM4E 1997/4885

“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.