SCHEMBL10132649

SCHEMBL10132649

COc1cc2c(ccc3c4ccc(C)c(OC(C)C)c4c[n+](C)c23)c(-c2ccccc2)c1OC

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAC1 P63000 3/20 0.41
CDC42 P60953 2/20 0.41
ALDH1A1 P00352 4/20 0.39
SMN1; SMN2 Q16637 3/20 0.39
HPGD P15428 3/20 0.39
BCHE P06276 2/20 0.39
MAPT P10636 2/20 0.39
ACHE P22303 2/20 0.39
MAPK1 P28482 2/20 0.39
KMT2A Q03164 2/20 0.39
CYP3A4 P08684 2/20 0.39
MEN1 O00255 1/20 0.39
ATP2A1 O14983 1/20 0.39
NPC1 O15118 1/20 0.39
USP2 O75604 1/20 0.39
TP53 P04637 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP2D6 P10635 1/20 0.39
THRB P10828 1/20 0.39
CYP2C9 P11712 1/20 0.39

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
SCHEMBL13284425 0.93 RAC1 (0.47) RAC1CDC42ALDH1A1SMN1; SMN2HPGD
SCHEMBL10132692 0.91 RAC1 (0.46) RAC1CDC42ALDH1A1SMN1; SMN2HPGD
SCHEMBL10132640 0.89 RAC1 (0.44) RAC1CDC42ALDH1A1SMN1; SMN2HPGD
SCHEMBL10132279 0.87 RAC1 (0.40) RAC1CDC42ALDH1A1SMN1; SMN2HPGD
SCHEMBL10162982 0.86 RAC1 (0.55) RAC1CDC42ALDH1A1SMN1; SMN2HPGD
SCHEMBL13284349 0.84 RAC1 (0.53) RAC1CDC42ALDH1A1SMN1; SMN2HPGD
SCHEMBL10132771 0.79 RAC1 (0.42) RAC1CDC42ALDH1A1SMN1; SMN2HPGD
SCHEMBL10132448 0.78 RAC1 (0.43) RAC1CDC42ALDH1A1SMN1; SMN2HPGD
SCHEMBL10132725 0.77 RAC1 (0.46) RAC1CDC42ALDH1A1SMN1; SMN2HPGD
SCHEMBL10132792 0.77 RAC1 (0.42) RAC1CDC42ALDH1A1SMN1; SMN2HPGD

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 RAC1 1000/4885CDC42 747/4885ALDH1A1 3095/4885

“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.