SCHEMBL13613539

SCHEMBL13613539

COc1ccc(C(=O)CC(Sc2ccc(Cl)cc2)c2ccccc2)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDPK1 O15530 1/20 0.57
L3MBTL1 Q9Y468 1/20 0.52
TRPA1 O75762 1/20 0.49
ALDH1A1 P00352 5/20 0.47
NPSR1 Q6W5P4 2/20 0.47
LMNA P02545 2/20 0.47
HSP90AA1 P07900 1/20 0.47
MAPT P10636 1/20 0.47
THRB P10828 1/20 0.47
HPGD P15428 1/20 0.47
NPC1 O15118 2/20 0.46
RAB9A P51151 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
TDP1 Q9NUW8 2/20 0.46
CDC25A P30304 1/20 0.45
CDC25B P30305 1/20 0.45
KCNH2 Q12809 1/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
CYP1A2 P05177 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
SCHEMBL8524120 0.86 L3MBTL1 (0.66) L3MBTL1ALDH1A1NPSR1LMNAMAPT
SCHEMBL28036009 0.82 L3MBTL1 (0.63) PDPK1L3MBTL1ALDH1A1NPSR1LMNA
SCHEMBL726709 0.81 ALDH1A1 (0.70) L3MBTL1TRPA1ALDH1A1NPSR1LMNA
SCHEMBL728190 0.81 ALDH1A1 (0.70) L3MBTL1TRPA1ALDH1A1NPSR1LMNA
SCHEMBL10537598 0.78 PDPK1 (0.54) PDPK1TRPA1LMNATHRBMEN1
SCHEMBL11528919 0.78 CYP2C9 (0.50) PDPK1L3MBTL1TRPA1ALDH1A1NPSR1
SCHEMBL6825864 0.78 MMP2 (0.57) NPSR1LMNAHPGDMEN1KMT2A
SCHEMBL27494318 0.78 SERPINH1 (0.46) L3MBTL1ALDH1A1NPSR1LMNAMAPT
SCHEMBL3412185 0.77 PDPK1 (0.52) PDPK1L3MBTL1ALDH1A1NPSR1LMNA
SCHEMBL12285419 0.77 PDPK1 (0.52) PDPK1L3MBTL1ALDH1A1LMNAMAPT

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-20090280483-A1 Methods for Screening Interleukin-6 (IL-6) Signal Transduction Inhibitors UNIVERSITY OF TOKYO, THE (JP) 2009-11-12 US disclosed
US-20090280483-A1 Methods for Screening Interleukin-6 (IL-6) Signal Transduction Inhibitors UNIVERSITY OF TOKYO, THE (JP) 2009-11-12 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-20090280483-A1 Methods for Screening Interleukin-6 (IL-6) Signal Transduction Inhibitors IL6, IL6ST, CASP6 PDPK1 370/4885L3MBTL1 1152/4885TRPA1 3960/4885

“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.