SCHEMBL14123774

SCHEMBL14123774

C=CC(=O)OCCN(C(=O)N(C)c1cccc(N(C)C(=O)N(CCOC(=O)C=C)c2cccc(C)c2)c1)c1cccc(C)c1

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HSD17B1 P14061 10/20 0.39
HSD17B2 P37059 10/20 0.39
RAB9A P51151 4/20 0.38
NPC1 O15118 3/20 0.38
ALDH1A1 P00352 2/20 0.38
PAX8 Q06710 2/20 0.38
TP53 P04637 1/20 0.38
GPX4 P36969 1/20 0.38
JAK2 O60674 1/20 0.37
HTT P42858 1/20 0.37
THRB P10828 1/20 0.36
POLQ O75417 1/20 0.35
SIGMAR1 Q99720 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
SCHEMBL14123772 0.89 THRB (0.45) ALDH1A1TP53THRB
SCHEMBL14123765 0.83 THRB (0.48) ALDH1A1TP53THRB
SCHEMBL14123777 0.82 THRB (0.43) RAB9ANPC1ALDH1A1PAX8JAK2
SCHEMBL14123725 0.82 THRB (0.47) ALDH1A1TP53THRB
SCHEMBL14123776 0.81 BCL2A1 (0.41) ALDH1A1TP53THRBSIGMAR1
SCHEMBL14123744 0.80 THRB (0.39) ALDH1A1TP53THRB
SCHEMBL14123775 0.79 ALDH1A1 (0.54) ALDH1A1TP53THRB
SCHEMBL20599113 0.78 GFER (0.45) ALDH1A1TP53HTTTHRB
SCHEMBL14123740 0.77 THRB (0.42) ALDH1A1THRB
SCHEMBL14123741 0.77 KMT2A (0.43) ALDH1A1TP53HTTTHRB

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 HSD17B1 4256/4885HSD17B2 4433/4885RAB9A 2306/4885

“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.