SCHEMBL10162969

SCHEMBL10162969

COc1cc2c(N=O)cccc2c(C2=CCCCC2)c1OC

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PSMB5 P28074 1/20 0.41
ALDH1A1 P00352 4/20 0.34
NPC1 O15118 2/20 0.34
RAB9A P51151 2/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
DYRK1A Q13627 1/20 0.32
MEN1 O00255 3/20 0.31
KMT2A Q03164 3/20 0.31
MAT2A P31153 1/20 0.31
MAPT P10636 3/20 0.30
NPSR1 Q6W5P4 2/20 0.30
KDM4E B2RXH2 1/20 0.30
HPGD P15428 1/20 0.30
MC4R P32245 1/20 0.30
PDE5A O76074 1/20 0.30
PDE4A P27815 1/20 0.30
PDE1A P54750 1/20 0.30
PDE1B Q01064 1/20 0.30
PDE4B Q07343 1/20 0.30
PDE4C Q08493 1/20 0.30

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
SCHEMBL10132668 0.82 PSMB5 (0.43) PSMB5ALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL10132665 0.80 PSMB5 (0.39) PSMB5ALDH1A1NPC1RAB9AMEN1
SCHEMBL10162996 0.73 L3MBTL1 (0.33) ALDH1A1NPC1SMN1; SMN2MEN1KMT2A
SCHEMBL10163138 0.72 KMT2A (0.41) ALDH1A1NPC1RAB9ASMN1; SMN2MEN1
SCHEMBL10163177 0.71 TUBB4A (0.44) ALDH1A1
SCHEMBL10163657 0.71 ALDH1A1 (0.33) PSMB5ALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL10161796 0.71 TUBB4A (0.36) NPC1SMN1; SMN2MEN1KMT2A
SCHEMBL10162998 0.71 POLB (0.45) NPC1
SCHEMBL10132675 0.70 PSMB5 (0.34) PSMB5ALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL10161774 0.69 CYP19A1 (0.37) PSMB5ALDH1A1MEN1KMT2AMAPT

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 PSMB5 1153/4885ALDH1A1 3095/4885NPC1 2668/4885

“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.