SCHEMBL9890308

SCHEMBL9890308

c1cc(-n2c3cccnc3c3cccnc32)c2oc3cc4c(cc3c2c1)oc1c(-n2c3cccnc3c3cccnc32)cccc14

nearest known ligand 0.33

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PDE4D Q08499 4/20 0.33
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
GAA P10253 1/20 0.33
HPGD P15428 1/20 0.33
CYP2C19 P33261 1/20 0.33
PDE4A P27815 3/20 0.32
PDE4B Q07343 2/20 0.32
PDE4C Q08493 2/20 0.32
KDM4E B2RXH2 2/20 0.32
MPI P34949 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
KMT2A Q03164 1/20 0.30
PKM P14618 1/20 0.30
PDE1A P54750 1/20 0.30
PDE1B Q01064 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
SCHEMBL9890329 0.89 PDE4D (0.36) PDE4DCYP1A2CYP3A4GAAHPGD
SCHEMBL9890306 0.88 CYP1A2 (0.36) PDE4DCYP1A2CYP3A4GAAHPGD
SCHEMBL9890314 0.88 KDM4E (0.32) CYP1A2CYP3A4GAAHPGDCYP2C19
SCHEMBL9890325 0.86 KDM4E (0.33) PDE4DCYP1A2CYP3A4GAAHPGD
SCHEMBL9890309 0.83 MAOA (0.32) PDE4DCYP1A2CYP3A4GAAHPGD
SCHEMBL9890312 0.83 PDPK1 (0.33) PDE4DCYP1A2CYP3A4GAAHPGD
SCHEMBL9890307 0.81 DDB1 (0.37)
SCHEMBL9890321 0.81 PDPK1 (0.34)
SCHEMBL13529130 0.79 NPC1 (0.35) PDE4DHPGDCYP2C19PDE4APDE4B
SCHEMBL12925817 0.78 PDE4D (0.33) PDE4DHPGDKDM4EKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130020563-A1 POLYCYCLIC COMPOUNDS AND ORGANIC ELECTROLUMINESCENCE DEVICE EMPLOYING THE SAME IDEMITSU KOSAN CO., LTD. (JP) 2013-01-24 US disclosed
US-20130020563-A1 POLYCYCLIC COMPOUNDS AND ORGANIC ELECTROLUMINESCENCE DEVICE EMPLOYING THE SAME IDEMITSU KOSAN CO., LTD. (JP) 2013-01-24 US disclosed
US-20120138915-A1 ORGANIC ELECTROLUMINESCENCE DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2012-06-07 US disclosed
US-20120138915-A1 ORGANIC ELECTROLUMINESCENCE DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2012-06-07 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-20130020563-A1 POLYCYCLIC COMPOUNDS AND ORGANIC ELECTROLUMINESCENCE DEVICE EMPLOYING THE SAME KCNC1, EED, BMI1 PDE4D 3820/4885CYP1A2 1931/4885CYP3A4 1516/4885

“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.