SCHEMBL14123773

SCHEMBL14123773

C=C(C)C(=O)OCCc1ccc(N(C)C(=O)N(C)c2cccc(N(C)C(=O)N(C)c3ccc(CCOC(=O)C(=C)C)cc3)c2)cc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.37
TDP1 Q9NUW8 2/20 0.34
POLB P06746 1/20 0.34
APEX1 P27695 1/20 0.34
HTT P42858 1/20 0.34
ALOX15 P16050 1/20 0.34
TSHR P16473 3/20 0.33
MEN1 O00255 4/20 0.33
KMT2A Q03164 4/20 0.33
CNR2 P34972 1/20 0.33
CHRNB2 P17787 1/20 0.33
CHRNB4 P30926 1/20 0.33
CHRNA3 P32297 1/20 0.33
CHRNA4 P43681 1/20 0.33
MTNR1A P48039 1/20 0.32
MTNR1B P49286 1/20 0.32
NLRP3 Q96P20 1/20 0.32
APP P05067 1/20 0.32
RAD52 P43351 1/20 0.32
NPC1 O15118 1/20 0.32

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
SCHEMBL14123735 0.92 THRB (0.42) THRBTDP1POLBAPEX1HTT
SCHEMBL14123734 0.82 THRB (0.42) THRBTDP1ALOX15TSHRMEN1
SCHEMBL7698399 0.81 THRB (0.45) THRBTDP1POLBAPEX1HTT
SCHEMBL9915738 0.80 THRB (0.45) THRBTDP1POLBAPEX1HTT
SCHEMBL21880709 0.80 THRB (0.45) THRBTDP1POLBAPEX1HTT
SCHEMBL14981546 0.80 THRB (0.50) THRBTDP1POLBAPEX1HTT
SCHEMBL2602483 0.79 THRB (0.44) THRBTDP1POLBAPEX1HTT
SCHEMBL14123770 0.79 ALDH1A1 (0.40) HTTNPC1ALDH1A1HPGDRAB9A
SCHEMBL11921516 0.79 THRB (0.55) THRBTDP1POLBAPEX1HTT
SCHEMBL2602558 0.78 THRB (0.49) THRBTDP1POLBAPEX1HTT

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-8962227-B2 Electrophotographic photosensitive member, process cartridge, electrophotographic apparatus, method of producing electrophotographic photosensitive member, and urea compound CANON KABUSHIKI KAISHA (JP) 2015-02-24 US disclosed
US-20120301177-A1 ELECTROPHOTOGRAPHIC PHOTOSENSITIVE MEMBER, PROCESS CARTRIDGE, ELECTROPHOTOGRAPHIC APPARATUS, METHOD OF PRODUCING ELECTROPHOTOGRAPHIC PHOTOSENSITIVE MEMBER, AND UREA COMPOUND CANON KABUSHIKI KAISHA (JP) 2012-11-29 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-20120301177-A1 ELECTROPHOTOGRAPHIC PHOTOSENSITIVE MEMBER, PROCESS CARTRIDGE, ELECTROPHOTOGRAPHIC APPARATUS, METHOD OF PRODUCING ELECTROPHOTOGRAPHIC PHOTOSENSITIVE MEMBER, AND UREA COMPOUND SLC14A1, ITCH, UROD THRB 4300/4885TDP1 4294/4885POLB 674/4885

“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.