SCHEMBL10132832

SCHEMBL10132832

COc1cc2c(ccc3c4ccc(C)c(C)c4c(=O)n(C)c23)c(-c2ccc(CCN3CCOCC3)cc2)c1OC

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ACHE P22303 2/20 0.38
LMNA P02545 2/20 0.38
HSD17B10 Q99714 1/20 0.38
MAPT P10636 2/20 0.37
TNIK Q9UKE5 1/20 0.37
MAPK1 P28482 1/20 0.37
SRC P12931 2/20 0.37
TLR9 Q9NR96 1/20 0.36
TLR8 Q9NR97 1/20 0.36
TLR7 Q9NYK1 1/20 0.36
HTT P42858 1/20 0.36
SYK P43405 2/20 0.36
AVPR1B P47901 2/20 0.35
TP53 P04637 1/20 0.35
KDM4E B2RXH2 2/20 0.35
BRD4 O60885 2/20 0.35
CREBBP Q92793 2/20 0.35
ALDH1A1 P00352 1/20 0.35
RAB9A P51151 1/20 0.35

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
SCHEMBL10163662 0.91 RXFP1 (0.40) ACHELMNAHSD17B10MAPTTNIK
SCHEMBL13284135 0.79 TNKS (0.45) TNIKTLR9TLR8TLR7SYK
SCHEMBL10132821 0.78 SRC (0.37) ACHELMNAHSD17B10MAPTTNIK
SCHEMBL10132826 0.74 ABCB1 (0.43) TNIKSRCTLR9TLR8TLR7
SCHEMBL13284185 0.74 TLR9 (0.39) ACHELMNAHSD17B10MAPTTNIK
SCHEMBL10132646 0.74 CYP19A1 (0.40) LMNAMAPTALDH1A1
SCHEMBL10163308 0.74 ABCB1 (0.41) ACHETNIKTLR9TLR8TLR7
SCHEMBL10132697 0.74 CYP19A1 (0.41) LMNAALDH1A1
SCHEMBL10132824 0.72 CHEK1 (0.44) TLR9TLR8TLR7HTTBRD4
SCHEMBL10132804 0.71 CYP19A1 (0.39) MAPK1BRD4ALDH1A1

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 ACHE 4187/4885LMNA 2208/4885HSD17B10 1744/4885

“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.