SCHEMBL19939366

SCHEMBL19939366

N#Cc1cccc(-c2ccc(-c3ccc(-c4ccc(-c5ccc6ccc7cccnc7c6n5)cc4)c4ccccc34)cc2)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4D Q08499 4/20 0.47
PDE4A P27815 2/20 0.47
PDE4C Q08493 2/20 0.47
CLK4 Q9HAZ1 1/20 0.44
ALDH1A3 P47895 1/20 0.42
CYP17A1 P05093 1/20 0.41
CYP11B1 P15538 1/20 0.41
CYP11B2 P19099 1/20 0.41
GRM5 P41594 2/20 0.41
GABRA1 P14867 1/20 0.41
GABRG2 P18507 1/20 0.41
GABRB3 P28472 1/20 0.41
GABRA5 P31644 1/20 0.41
GABRA3 P34903 1/20 0.41
TDO2 P48775 1/20 0.41
FABP1 P07148 1/20 0.41
SLC40A1 Q9NP59 2/20 0.40
NEK1 Q96PY6 1/20 0.40
PDE4B Q07343 1/20 0.40
GLO1 Q04760 1/20 0.40

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
SCHEMBL19939362 0.97 PDE4D (0.48) PDE4DPDE4APDE4CCLK4ALDH1A3
SCHEMBL19939361 0.89 FABP1 (0.47) PDE4DPDE4APDE4CALDH1A3CYP17A1
SCHEMBL23020058 0.88 PDE4A (0.42) PDE4DPDE4APDE4CCLK4ALDH1A3
SCHEMBL19939363 0.88 FABP1 (0.47) PDE4DPDE4APDE4CCYP17A1CYP11B1
SCHEMBL23020109 0.86 ALDH1A3 (0.46) CLK4ALDH1A3CYP17A1CYP11B1CYP11B2
SCHEMBL22115384 0.84 FABP1 (0.47) CYP17A1CYP11B1CYP11B2TDO2FABP1
SCHEMBL23020108 0.82 GRM5 (0.42) GRM5
SCHEMBL21396159 0.82 PGR (0.46) PDE4DPDE4APDE4CCLK4CYP17A1
SCHEMBL20713520 0.82 SLC40A1 (0.39) PDE4DPDE4APDE4CCYP17A1CYP11B1
SCHEMBL15603719 0.82 PGR (0.46) PDE4DPDE4APDE4CCLK4CYP17A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180066180-A1 ORGANIC LIGHT-EMITTING DEVICE LG CHEM, LTD. (KR) 2018-03-08 US disclosed
US-20180066180-A1 ORGANIC LIGHT-EMITTING DEVICE LG CHEM, LTD. (KR) 2018-03-08 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-20180066180-A1 ORGANIC LIGHT-EMITTING DEVICE CRY1, CRY2, PPOX PDE4D 4170/4885PDE4A 4438/4885PDE4C 4342/4885

“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.