SCHEMBL16405706

SCHEMBL16405706

Cc1ccc(-c2ccc(N3C(=O)c4ccc(-c5ccc6c(c5)C(=O)N(c5ccc(-c7ccc(N8C(=O)c9ccc(-c%10ccc%11c(c%10)C(=O)N(C)C%11=O)cc9C8=O)cc7C(F)(F)F)c(C)c5)C6=O)cc4C3=O)cc2-c2cccnc2)c(-c2cccnc2)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE3B Q13370 4/20 0.39
PDE3A Q14432 4/20 0.39
S1PR1 P21453 1/20 0.37
S1PR3 Q99500 1/20 0.37
TP53 P04637 1/20 0.37
CA9 Q16790 2/20 0.36
CA12 O43570 1/20 0.36
CA1 P00915 1/20 0.36
AR P10275 1/20 0.36
KDM4E B2RXH2 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
BTK Q06187 1/20 0.35
POLB P06746 1/20 0.35
CFTR P13569 1/20 0.35
SLC2A1 P11166 1/20 0.35
CYP3A4 P08684 1/20 0.35
HTT P42858 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
GAA P10253 1/20 0.34

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
SCHEMBL2600183 0.85 ALDH1A1 (0.41) PDE3BPDE3ACA9CA12CA1
SCHEMBL13400483 0.82 ALDH1A1 (0.44) PDE3BPDE3ACA9CA12CA1
SCHEMBL12325081 0.77 ALDH1A1 (0.49) CA9CA12CA1L3MBTL1POLB
SCHEMBL15445508 0.74 ALDH1A1 (0.38) PDE3BPDE3ACA9CA12CA1
SCHEMBL9927356 0.74 ALDH1A1 (0.38) CA9CA12CA1L3MBTL1POLB
SCHEMBL19399219 0.74 ALDH1A1 (0.39) CA9CA12CA1L3MBTL1POLB
SCHEMBL17721621 0.73 GRM2 (0.35) PDE3BPDE3AKDM4EL3MBTL1SMN1; SMN2
SCHEMBL19765587 0.73 MEN1 (0.60) CA9NPSR1
SCHEMBL15431056 0.73 ALDH1A1 (0.56) CA9CA12CA1ARPOLB
SCHEMBL13967730 0.73 CA9 (0.38) CA9CA12CA1POLBNPSR1

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-9353222-B2 Composition, polymer film, and display device SAMSUNG ELECTRONICS CO., LTD. (KR) 2016-05-31 US disclosed
US-20150025200-A1 COMPOSITION, POLYMER FILM, AND DISPLAY DEVICE SAMSUNG ELECTRONICS CO., LTD. (KR) 2015-01-22 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-20150025200-A1 COMPOSITION, POLYMER FILM, AND DISPLAY DEVICE DDT, DTD1, DRD1 PDE3B 2215/4885PDE3A 1832/4885S1PR1 3169/4885

“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.