SCHEMBL14729236

SCHEMBL14729236

C=Cc1ccc(COC(=O)C(Cc2ccc(N(c3ccc(C)c(C)c3)c3ccc(-c4ccc(N(c5ccc(CC(C(=O)OCc6ccc(C=C)cc6)C(=O)OCc6ccc(C=C)cc6)cc5)c5ccc(C)c(C)c5)c(C)c4)cc3C)cc2)C(=O)OCc2ccc(C=C)cc2)cc1

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
NPY1R P25929 1/20 0.31
NPY2R P49146 1/20 0.31

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
SCHEMBL14729244 0.87 MEN1 (0.34) MAPTMEN1KMT2ANPY1RNPY2R
SCHEMBL14729230 0.86 NPY1R (0.40) NPY1RNPY2R
SCHEMBL14732627 0.85 CYP4F2 (0.38) MAPTMEN1KMT2A
SCHEMBL14729234 0.83
SCHEMBL279030 0.80 ALDH1A1 (0.36) MAPTMEN1KMT2A
SCHEMBL14063409 0.79 ALDH1A1 (0.40) MAPTMEN1KMT2A
SCHEMBL12261355 0.79 CYP4F2 (0.41) MAPTMEN1KMT2A
SCHEMBL2602593 0.78 MEN1 (0.32) MAPTMEN1KMT2A
SCHEMBL22373732 0.77
SCHEMBL14063411 0.77 MCL1 (0.36) MAPTMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8846280-B2 Compound, charge transporting film, photoelectric conversion device, electrophotographic photoreceptor, process cartridge, and image forming apparatus FUJI XEROX CO., LTD. (JP) 2014-09-30 US disclosed
US-8846280-B2 Compound, charge transporting film, photoelectric conversion device, electrophotographic photoreceptor, process cartridge, and image forming apparatus FUJI XEROX CO., LTD. (JP) 2014-09-30 US disclosed
US-20130052571-A1 NOVEL COMPOUND, CHARGE TRANSPORTING FILM, PHOTOELECTRIC CONVERSION DEVICE, ELECTROPHOTOGRAPHIC PHOTORECEPTOR, PROCESS CARTRIDGE, AND IMAGE FORMING APPARATUS FUJI XEROX CO., LTD. (JP) 2013-02-28 US disclosed
US-20130052571-A1 NOVEL COMPOUND, CHARGE TRANSPORTING FILM, PHOTOELECTRIC CONVERSION DEVICE, ELECTROPHOTOGRAPHIC PHOTORECEPTOR, PROCESS CARTRIDGE, AND IMAGE FORMING APPARATUS FUJI XEROX CO., LTD. (JP) 2013-02-28 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-20130052571-A1 NOVEL COMPOUND, CHARGE TRANSPORTING FILM, PHOTOELECTRIC CONVERSION DEVICE, ELECTROPHOTOGRAPHIC PHOTORECEPTOR, PROCESS CARTRIDGE, AND IMAGE FORMING APPARATUS SCNN1G, SCNN1B, ARL1 MAPT 3675/4885MEN1 2802/4885KMT2A 3463/4885

“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.