SCHEMBL20108898

SCHEMBL20108898

O=P(c1ccccc1)(c1ccccc1)c1ccc(-c2ccc3ccc4ccc(-c5ccc6ccccc6c5)nc4c3n2)cn1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOS1 P29475 1/20 0.39
CYP1A1 P04798 1/20 0.38
CYP1B1 Q16678 1/20 0.38
CA12 O43570 1/20 0.36
CYP11B1 P15538 3/20 0.36
CYP11B2 P19099 3/20 0.36
CYP1A2 P05177 2/20 0.36
CYP17A1 P05093 1/20 0.36
CYP19A1 P11511 1/20 0.36
FTO Q9C0B1 1/20 0.36
EGLN1 Q9GZT9 1/20 0.36
EGLN3 Q9H6Z9 1/20 0.36
TOP1 P11387 1/20 0.35
CTRC Q99895 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
CLK2 P49760 1/20 0.35
HIPK1 Q86Z02 1/20 0.35
DYRK2 Q92630 1/20 0.35
HIPK2 Q9H2X6 1/20 0.35

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
SCHEMBL20108878 0.89 PARP1 (0.40) NOS1TOP1MEN1KMT2AALDH1A1
SCHEMBL20108872 0.87 CCR1 (0.41) EGLN1TOP1ALDH1A1KDM4EMAPT
SCHEMBL20108846 0.85 CYP1A1 (0.45) NOS1CYP1A1CYP1B1CA12CYP11B1
SCHEMBL20108896 0.85 NOS1 (0.39) NOS1CYP1A1CYP1B1CA12CYP11B1
SCHEMBL20108906 0.85 NOS1 (0.39) NOS1CYP1A1CYP1B1CA12CYP11B1
SCHEMBL20108903 0.81 CYP1A1 (0.37) CYP1A1CYP1B1CYP11B1CYP11B2EGLN3
SCHEMBL20108851 0.78 PARP1 (0.44) TOP1MEN1KMT2AALDH1A1NPSR1
SCHEMBL20108877 0.77 PARP1 (0.43) CYP1A1CYP1B1CYP11B1CYP11B2CYP17A1
SCHEMBL30414157 0.77 CYP1A2 (0.55) NOS1CYP1A1CYP1B1CA12CYP11B1
SCHEMBL16542814 0.77 CYP1A2 (0.55) NOS1CYP1A1CYP1B1CA12CYP11B1

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-11155543-B2 Organic compound, and organic light emitting diode and organic light emitting display device including the same LG DISPLAY CO., LTD. (KR) 2021-10-26 US disclosed
US-20180118742-A1 ORGANIC COMPOUND, AND ORGANIC LIGHT EMITTING DIODE AND ORGANIC LIGHT EMITTING DISPLAY DEVICE INCLUDING THE SAME LG DISPLAY CO., LTD. (KR) 2018-05-03 US disclosed
US-20180118742-A1 ORGANIC COMPOUND, AND ORGANIC LIGHT EMITTING DIODE AND ORGANIC LIGHT EMITTING DISPLAY DEVICE INCLUDING THE SAME LG DISPLAY CO., LTD. (KR) 2018-05-03 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-20180118742-A1 ORGANIC COMPOUND, AND ORGANIC LIGHT EMITTING DIODE AND ORGANIC LIGHT EMITTING DISPLAY DEVICE INCLUDING THE SAME OCIAD2, OCIAD1, PPOX NOS1 1081/4885CYP1A1 984/4885CYP1B1 1088/4885
US-11155543-B2 Organic compound, and organic light emitting diode and organic light emitting display device including the same OCIAD2, OCIAD1, PPOX NOS1 1081/4885CYP1A1 984/4885CYP1B1 1088/4885

“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.