SCHEMBL10163285

SCHEMBL10163285

COc1cc2c(ccc3c4ccc(OC)c(OC)c4c(=O)n(C)c23)c(C2CCCCC2)c1OC

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 3/20 0.41
NQO2 P16083 3/20 0.41
DRD1 P21728 2/20 0.35
DRD5 P21918 2/20 0.35
KMT2A Q03164 2/20 0.35
ALDH1A1 P00352 5/20 0.35
HPGD P15428 2/20 0.35
KDM4E B2RXH2 2/20 0.34
HTT P42858 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
ACHE P22303 1/20 0.34
MAPT P10636 2/20 0.34
NPSR1 Q6W5P4 1/20 0.34
MEN1 O00255 1/20 0.34
CYP3A4 P08684 1/20 0.34
ALOX15 P16050 1/20 0.34
CASP1 P29466 1/20 0.34
HSD17B10 Q99714 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
TSHR P16473 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
SCHEMBL10161775 0.94 CYP19A1 (0.43) CYP19A1NQO2KMT2AALDH1A1HPGD
SCHEMBL10132678 0.91 CYP19A1 (0.41) CYP19A1NQO2DRD1DRD5KMT2A
SCHEMBL10132690 0.85 CYP19A1 (0.43) CYP19A1NQO2KMT2AALDH1A1HPGD
SCHEMBL10163174 0.78 PDE3B (0.45) CYP19A1NQO2ALDH1A1HPGDKDM4E
SCHEMBL10163115 0.77 TDP1 (0.50) CYP19A1NQO2ALDH1A1HPGDKDM4E
SCHEMBL10163171 0.76 CYP19A1 (0.41) CYP19A1NQO2ALDH1A1ACHEMAPT
SCHEMBL10161774 0.76 CYP19A1 (0.37) CYP19A1NQO2KMT2AALDH1A1HPGD
SCHEMBL10163184 0.75 CYP19A1 (0.40) CYP19A1NQO2KMT2AALDH1A1HPGD
SCHEMBL10163291 0.75 ALDH1A1 (0.40) CYP19A1NQO2ALDH1A1ACHEMAPT
SCHEMBL10163000 0.73 GAA (0.40) CYP19A1NQO2KMT2AALDH1A1HPGD

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 3 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
WO-2010083436-A1 BENZO [C] PHENANTHRIDINES AS ANTIMICROBIAL AGENTS RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2010-07-22 WO 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 CYP19A1 596/4885NQO2 50/4885DRD1 2700/4885

“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.