SCHEMBL14123736

SCHEMBL14123736

C=CC(=O)OCCc1cccc(N(C)C(=O)N(C)c2cccc(N(C)C(=O)N(C)c3cccc(COC(=O)C=C)c3)c2)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 2/20 0.40
CA4 P22748 2/20 0.40
CA6 P23280 2/20 0.40
CA5A P35218 2/20 0.40
CA7 P43166 2/20 0.40
CA9 Q16790 2/20 0.40
CA14 Q9ULX7 2/20 0.40
CA5B Q9Y2D0 2/20 0.40
CA1 P00915 1/20 0.40
THRB P10828 1/20 0.39
AKR1B10 O60218 5/20 0.39
AKR1B1 P15121 5/20 0.39
HCAR2 Q8TDS4 4/20 0.36
ALOX5 P09917 4/20 0.36
MAOB P27338 1/20 0.35
TYR P14679 1/20 0.35
KDM4E B2RXH2 1/20 0.35
ALDH1A1 P00352 1/20 0.35
MAPT P10636 1/20 0.35
RAB9A P51151 1/20 0.35

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
SCHEMBL14123766 0.92 HCAR2 (0.41) THRBHCAR2KDM4EALDH1A1MAPT
SCHEMBL16518669 0.89 HCAR2 (0.40) CA12CA4CA6CA5ACA7
SCHEMBL14123734 0.87 THRB (0.42) CA12CA4CA6CA5ACA7
SCHEMBL14135474 0.82 HCAR2 (0.34) THRBHCAR2KDM4EALDH1A1MAPT
SCHEMBL19730256 0.80 CA12 (0.47) CA12CA4CA6CA5ACA7
SCHEMBL19730209 0.79 CA12 (0.46) CA12CA4CA6CA5ACA7
SCHEMBL14123763 0.79 THRB (0.44) CA12CA4CA6CA5ACA7
SCHEMBL19456746 0.78 THRB (0.56) CA12CA4CA6CA5ACA7
SCHEMBL1119161 0.76 CA12 (0.64) CA12CA4CA6CA5ACA7
SCHEMBL31744993 0.76 CA12 (0.64) CA12CA4CA6CA5ACA7

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 CA12 3452/4885CA4 2966/4885CA6 3209/4885

“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.