SCHEMBL14123747

SCHEMBL14123747

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

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 6/20 0.44
TSHR P16473 4/20 0.38
HPGD P15428 1/20 0.38
BCL2A1 Q16548 1/20 0.36
HCAR2 Q8TDS4 1/20 0.36
AKR1B10 O60218 3/20 0.36
AKR1B1 P15121 3/20 0.36
ALDH1A1 P00352 3/20 0.35
GLA P06280 1/20 0.35
TRPM8 Q7Z2W7 1/20 0.34
TP53 P04637 2/20 0.34
HIF1A Q16665 2/20 0.34
HSD17B10 Q99714 1/20 0.34
CA12 O43570 1/20 0.34
CA1 P00915 1/20 0.34
MET P08581 1/20 0.34
CA4 P22748 1/20 0.34
CA6 P23280 1/20 0.34
CA5A P35218 1/20 0.34
CA7 P43166 1/20 0.34

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
SCHEMBL14123769 0.93 THRB (0.50) THRBTSHRHPGDBCL2A1HCAR2
SCHEMBL19532027 0.83 ALDH1A1 (0.55) THRBTSHRHPGDHCAR2AKR1B10
SCHEMBL14123738 0.83 THRB (0.49) THRBTSHRHPGDBCL2A1HCAR2
SCHEMBL14123734 0.81 THRB (0.42) THRBTSHRHPGDHCAR2AKR1B10
SCHEMBL9659189 0.80 THRB (0.49) THRBTSHRHPGDHCAR2ALDH1A1
SCHEMBL14123775 0.80 ALDH1A1 (0.54) THRBTSHRHPGDALDH1A1GLA
SCHEMBL147731 0.78 THRB (0.68) THRBTSHRHPGDHCAR2AKR1B10
SCHEMBL22349210 0.78 ALOX5 (0.42) THRBTSHRHPGDHCAR2AKR1B10
SCHEMBL20733442 0.78 THRB (0.55) THRBTSHRHPGDHCAR2AKR1B10
SCHEMBL9915737 0.78 THRB (0.55) THRBTSHRHPGDHCAR2AKR1B10

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 4300/4885TSHR 3941/4885HPGD 688/4885

“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.