SCHEMBL13899693

SCHEMBL13899693

CCCCCCn1c2ccc(Cl)cc2c(=O)c2cc3c(cc21)c(=O)c1cc(Cl)ccc1n3CCCCCC

nearest known ligand 0.66

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PSEN1 P49768 7/20 0.66
PSEN2 P49810 7/20 0.66
APH1B Q8WW43 7/20 0.66
NCSTN Q92542 7/20 0.66
APH1A Q96BI3 7/20 0.66
PSENEN Q9NZ42 7/20 0.66
CNR2 P34972 2/20 0.47
RORA P35398 1/20 0.46
RORC P51449 1/20 0.46
NR1H2 P55055 1/20 0.46
RORB Q92753 1/20 0.46
MAPK8 P45983 1/20 0.46
DPP4 P27487 1/20 0.46
GSK3B P49841 1/20 0.44

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
SCHEMBL551120 0.91 PSEN1 (0.77) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL8086740 0.84 RORA (0.55) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL29543602 0.84 RORA (0.55) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL16786336 0.84 RORA (0.57) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL12810417 0.83 CNR2 (0.52) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL13933210 0.83 CNR2 (0.52) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL14493934 0.82 SLC6A4 (0.63) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL14493937 0.82 SLC6A4 (0.63) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL1415590 0.82 FABP4 (0.54) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL9976717 0.82 PSEN1 (0.72) PSEN1PSEN2APH1BNCSTNAPH1A

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-20090057613-A1 FLUORESCENT QUINACRIDONES CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2009-03-05 US disclosed
US-20090057613-A1 FLUORESCENT QUINACRIDONES CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2009-03-05 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-20090057613-A1 FLUORESCENT QUINACRIDONES TYR, IK, MC1R PSEN1 3350/4885PSEN2 4399/4885APH1B 3159/4885

“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.