SCHEMBL14768931

SCHEMBL14768931

O=C1c2ccc3c4c(ccc(c24)C(=O)C1c1ccccc1)C(=O)C(c1ccncc1)C3=O

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 5/20 0.72
MAPT P10636 4/20 0.72
NPC1 O15118 4/20 0.72
TP53 P04637 3/20 0.72
SMN1; SMN2 Q16637 2/20 0.72
MAPK10 P53779 1/20 0.72
LMNA P02545 1/20 0.59
CYP1A2 P05177 1/20 0.59
CYP3A4 P08684 1/20 0.59
MAPK1 P28482 1/20 0.59
HTR2B P41595 1/20 0.59
CYP19A1 P11511 3/20 0.44
HPGD P15428 1/20 0.43
MAOA P21397 1/20 0.43
PTGS2 P35354 1/20 0.43
KMT2A Q03164 5/20 0.43
MEN1 O00255 4/20 0.43
KDM4E B2RXH2 2/20 0.43
GAA P10253 2/20 0.43
ALDH1A1 P00352 2/20 0.42

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
SCHEMBL855370 0.84 RAB9A (1.00) RAB9AMAPTNPC1TP53SMN1; SMN2
Phenindione SCHEMBL33831 0.75 MAPT (1.00) RAB9AMAPTNPC1TP53SMN1; SMN2
Phenindione SCHEMBL29388073 0.75 MAPT (1.00) RAB9AMAPTNPC1TP53SMN1; SMN2
Phenindione SCHEMBL1443973 0.73 MAPT (0.95) RAB9AMAPTNPC1TP53SMN1; SMN2
SCHEMBL10559114 0.73 MAPT (0.95) RAB9AMAPTNPC1TP53SMN1; SMN2
Phenindione SCHEMBL6827577 0.73 MAPT (0.95) RAB9AMAPTNPC1TP53SMN1; SMN2
SCHEMBL6274633 0.73 RAB9A (0.76) RAB9AMAPTNPC1TP53SMN1; SMN2
Phenindione SCHEMBL16782144 0.71 MAPT (0.91) RAB9AMAPTNPC1TP53SMN1; SMN2
SCHEMBL21048546 0.69 MAPT (0.62) RAB9AMAPTNPC1TP53SMN1; SMN2
SCHEMBL14940174 0.68 MAPT (0.63) RAB9AMAPTNPC1TP53SMN1; SMN2

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-8470075-B2 Tetratopic phenyl compounds, related metal-organic framework materials and post-assembly elaboration NORTHWESTERN UNIVERSITY (US) 2013-06-25 US disclosed
US-20130061752-A1 Tetratopic Phenyl Compounds, Related Metal-Organic Framework Materials and Post-Assembly Elaboration NORTHWESTERN UNIVERSITY (US) 2013-03-14 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-20130061752-A1 Tetratopic Phenyl Compounds, Related Metal-Organic Framework Materials and Post-Assembly Elaboration TPR, FABP7, PAICS RAB9A 4031/4885MAPT 206/4885NPC1 1251/4885

“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.