SCHEMBL13572447

SCHEMBL13572447

CCCCCCCCCCCCOc1cc(N2C(=O)c3ccc4c5c(OCc6ccc(N(c7ccccc7)c7ccccc7)cc6)cc6c7c(ccc(c8c(OCc9ccc(N(c%10ccccc%10)c%10ccccc%10)cc9)cc(c3c48)C2=O)c75)C(=O)N(c2cc(OCCCCCCCCCCCC)c(OCCCCCCCCCCCC)c(OCCCCCCCCCCCC)c2)C6=O)cc(OCCCCCCCCCCCC)c1OCCCCCCCCCCCC

nearest known ligand 0.35

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ PPARA Q07869 4/20 0.35
▸ PPARG P37231 3/20 0.35
▸ PPARD Q03181 3/20 0.35
▸ GRM5 P41594 5/20 0.35
▸ MEN1 O00255 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ CDC25A P30304 1/20 0.33
▸ CDC25B P30305 1/20 0.33
▸ CDC25C P30307 1/20 0.33
▸ POLB P06746 1/20 0.33
▸ CNR2 P34972 3/20 0.32
▸ MCHR1 Q99705 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.30
▸ GAA P10253 1/20 0.30
▸ MAPT P10636 1/20 0.30
▸ HTT P42858 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
SCHEMBL13572451 0.92 GRM5 (0.38) PPARAPPARGPPARDGRM5MEN1
SCHEMBL13572446 0.89 MCHR1 (0.35) PPARAPPARGPPARDMEN1KMT2A
SCHEMBL14706338 0.82 GAA (0.38) PPARAPPARGPPARDMEN1KMT2A
SCHEMBL14706551 0.82 MEN1 (0.41) PPARAPPARGPPARDGRM5MEN1
SCHEMBL13572450 0.81 ALDH1A1 (0.33) PPARAPPARGPPARDMEN1KMT2A
SCHEMBL13572449 0.81 MAPT (0.36) PPARAPPARGPPARDGRM5MEN1
SCHEMBL14706337 0.78 THRA (0.35) PPARAPPARGPPARDCNR2ALDH1A1
SCHEMBL14706336 0.77 PPARG (0.36) PPARAPPARGPPARDMEN1KMT2A
SCHEMBL14706340 0.77 MCHR1 (0.32) PPARAPPARGPPARDCDC25ACDC25B
SCHEMBL6793004 0.75 ALDH1A1 (0.32) PPARAPPARGPPARDCDC25ACDC25B

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-8378336-B2 Liquid crystalline organic semiconductor material and organic electron device FUJIFILM CORPORATION (JP) 2013-02-19 — — US disclosed
US-20090315025-A1 LIQUID CRYSTALLINE ORGANIC SEMICONDUCTOR MATERIAL AND ORGANIC ELECTRON DEVICE FUJIFILM CORPORATION (JP) 2009-12-24 — — 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-20090315025-A1 LIQUID CRYSTALLINE ORGANIC SEMICONDUCTOR MATERIAL AND ORGANIC ELECTRON DEVICE NONO, OCIAD2, PNN PPARA 3916/4885PPARG 3569/4885PPARD 2934/4885

“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.

Send feedback