SCHEMBL10132767

SCHEMBL10132767

COc1cc(-c2c(OC)c(OC)cc3c(N(C)C(=O)c4c(Br)ccc(CO)c4CO)cccc23)cc(CO)c1OC

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE3B Q13370 9/20 0.42
PDE3A Q14432 9/20 0.42
PDE5A O76074 7/20 0.42
PDE4A P27815 7/20 0.42
PDE4B Q07343 7/20 0.42
PDE4C Q08493 7/20 0.42
PDE4D Q08499 7/20 0.42
PDE1A P54750 9/20 0.39
PDE1B Q01064 9/20 0.39
PDE1C Q14123 9/20 0.39
KMT2A Q03164 1/20 0.34
NPSR1 Q6W5P4 2/20 0.33
TP53 P04637 1/20 0.33
TUBB4A P04350 1/20 0.33
TUBB P07437 1/20 0.33
TUBA3C P0DPH7 1/20 0.33
TUBA1B P68363 1/20 0.33
TUBA4A P68366 1/20 0.33
TUBB4B P68371 1/20 0.33
TUBB3 Q13509 1/20 0.33

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
SCHEMBL10132788 0.90 PDE5A (0.38) PDE3BPDE3APDE5APDE4APDE4B
SCHEMBL10162955 0.83 PDE3B (0.39) PDE3BPDE3APDE5APDE4APDE4B
SCHEMBL10132758 0.81 PDE3B (0.43) PDE3BPDE3APDE5APDE4APDE4B
SCHEMBL10163166 0.79 TUBB4A (0.42) KMT2ANPSR1TP53TUBB4ATUBB
SCHEMBL10132857 0.78 NPSR1 (0.38) PDE3BPDE3APDE5APDE4APDE4B
SCHEMBL10163248 0.77 TUBB4A (0.41) KMT2ANPSR1TP53TUBB4ATUBB
SCHEMBL10132696 0.77 TUBB4A (0.41) NPSR1TP53TUBB4ATUBBTUBA3C
SCHEMBL10163168 0.76 GAA (0.39) PDE3BPDE3APDE1APDE1BPDE1C
SCHEMBL10132643 0.76 TUBB4A (0.40) KMT2ANPSR1TP53TUBB4ATUBB
SCHEMBL10163179 0.75 TUBB4A (0.41) KMT2ANPSR1TP53TUBB4ATUBB

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-8741917-B2 Benzo [C] phenanthridines as antimicrobial agents RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2014-06-03 US disclosed
US-20120022061-A1 BENZO [C] PHENANTHRIDINES AS ANTIMICROBIAL AGENTS RUGTERS, THE STATE UNIVERSITY OF NEW JERSEY 2012-01-26 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-20120022061-A1 BENZO [C] PHENANTHRIDINES AS ANTIMICROBIAL AGENTS CCNT1, XPO4, XDH PDE3B 2429/4885PDE3A 3139/4885PDE5A 3412/4885

“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.