SCHEMBL6834819

SCHEMBL6834819

Cc1ccc(N(C)C2(N(C)c3ccc(C)cc3)OC(=O)c3cc(N(C)C)ccc32)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.56
HPGD P15428 2/20 0.56
TDP1 Q9NUW8 2/20 0.56
HSD17B10 Q99714 2/20 0.56
CYP3A4 P08684 1/20 0.56
HIF1A Q16665 1/20 0.56
MEN1 O00255 3/20 0.45
KMT2A Q03164 3/20 0.45
TSHR P16473 1/20 0.39
CES1 P23141 1/20 0.35
CRHBP P24387 2/20 0.33
CRHR2 Q13324 2/20 0.33
PTPRC P08575 1/20 0.33
LMNA P02545 3/20 0.32
NPSR1 Q6W5P4 3/20 0.32
PDK2 Q15119 1/20 0.31
KDM4E B2RXH2 2/20 0.31
MAPT P10636 2/20 0.31
POLB P06746 1/20 0.31
ALOX12 P18054 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
SCHEMBL6832673 0.87 ALDH1A1 (0.43) ALDH1A1HPGDTDP1HSD17B10CYP3A4
SCHEMBL6832708 0.86 ALDH1A1 (0.44) ALDH1A1HPGDTDP1HSD17B10CYP3A4
SCHEMBL4615007 0.86 MEN1 (0.55) ALDH1A1HPGDTDP1HSD17B10CYP3A4
SCHEMBL10933724 0.85 ALDH1A1 (0.65) ALDH1A1HPGDTDP1HSD17B10CYP3A4
SCHEMBL6829601 0.84 NPSR1 (0.43) ALDH1A1HPGDTDP1HSD17B10CYP3A4
SCHEMBL6833063 0.76 ALDH1A1 (0.46) ALDH1A1HPGDTDP1HSD17B10CYP3A4
SCHEMBL5143698 0.76 ALDH1A1 (0.66) ALDH1A1HPGDTDP1HSD17B10CYP3A4
SCHEMBL29381342 0.75 ALDH1A1 (0.79) ALDH1A1HPGDTDP1HSD17B10CYP3A4
SCHEMBL311267 0.75 ALDH1A1 (0.79) ALDH1A1HPGDTDP1HSD17B10CYP3A4
SCHEMBL6744454 0.75 ALDH1A1 (0.65) ALDH1A1HPGDTDP1HSD17B10CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6747170-B2 LEUCO DYES; MOLECULE HAVING AT LEAST TWO AROMATIC RINGS, TWO CARBOXYL GROUPS, AND EITHER TWO AMIDES OR TWO ESTERS; PRESERVATION STABILITY RICOH COMPANY, LTD. (JP) 2004-06-08 US disclosed
US-20040071187-A1 Thermosensitive recording material and color developer compound therefor HAYAKAWA KUNIO (JP) 2004-04-15 US disclosed
US-6555705-B1 A supported thermosensitive recording layer containing a leuco dye and a color developer to induce color in the leuco dye upon heating; using 4-(2- or 4-phenoxyethoxy- or butoxy phthalic acid; image stability; oil, fat repellant RICOH COMPANY, LTD. (JP) 2003-04-29 US disclosed
US-6180560-B1 LEUCO DYE AND DYE DEVELOPER OF AROMATIC AMIDE OR ESTER; PRESERVATION STABILITY RICOH COMPANY, LTD. (JP) 2001-01-30 US disclosed
EP-0612628-B1 Thermosensitive recording material using phthalic acid derivatives RICOH KK (JP) 1996-07-10 EP disclosed
US-5482912-A DEVELOPERS, THERMAL PRINTING, INTERMEDIATE LAYER OF THERMOPLASTIC HOLLOW SPHERES RICOH COMPANY, LTD. (JP) 1996-01-09 US disclosed
EP-0612628-A1 Thermosensitive recording material using phthalic acid derivatives Ricoh Company, Ltd (JP) 1994-08-31 EP 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-20040071187-A1 Thermosensitive recording material and color developer compound therefor LRBA, THEM6, GOT1 ALDH1A1 274/4885HPGD 1896/4885TDP1 3656/4885

“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.