SCHEMBL12809648

SCHEMBL12809648

COc1cc2ccccc2c2c1C(C)(C)C(=O)N2c1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PGR P06401 2/20 0.39
▸ ALDH1A1 P00352 6/20 0.39
▸ POLB P06746 2/20 0.39
▸ MAPT P10636 5/20 0.38
▸ HPGD P15428 4/20 0.38
▸ HSD11B1 P28845 4/20 0.38
▸ NPSR1 Q6W5P4 1/20 0.38
▸ GAA P10253 1/20 0.37
▸ MARK3 P27448 1/20 0.37
▸ LMNA P02545 1/20 0.36
▸ ATM Q13315 1/20 0.36
▸ SMN1; SMN2 Q16637 2/20 0.36
▸ TP53 P04637 1/20 0.36
▸ CYP1A2 P05177 1/20 0.36
▸ BRCA1 P38398 1/20 0.36
▸ HNF4A P41235 1/20 0.36
▸ HIF1A Q16665 1/20 0.36
▸ ALOX15 P16050 1/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ KMT2A Q03164 1/20 0.36

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
SCHEMBL12647692 0.83 PGR (0.41) PGRALDH1A1MAPTHPGDMARK3
SCHEMBL12647693 0.74 KDM4E (0.43) ALDH1A1MAPTHPGDNPSR1GAA
SCHEMBL12809947 0.69 ALDH1A1 (0.42) ALDH1A1MAPTHPGDNPSR1SMN1; SMN2
SCHEMBL1408900 0.69 MAPT (0.39) ALDH1A1MAPTHPGDNPSR1LMNA
SCHEMBL12809942 0.68 ACACA (0.39) ALDH1A1MAPTHPGDNPSR1GAA
SCHEMBL10948887 0.66 ELANE (0.63) PGRALDH1A1GAAMARK3
SCHEMBL1408738 0.66 MEN1 (0.39) ALDH1A1MAPTNPSR1LMNAMEN1
SCHEMBL11654508 0.63 PGR (0.58) PGRALDH1A1GAAMARK3
SCHEMBL6370043 0.63 GPR84 (0.58) ALDH1A1MAPTHPGDNPSR1LMNA
SCHEMBL11747305 0.62 ALDH1A1 (0.62) ALDH1A1POLBMAPTHPGDGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1034221-B1 DIBENZORHODAMINE DYES USEFUL AS FLUORESCENT LABELLING AGENTS LIFE TECHNOLOGIES CORP (US) 2014-05-14 — — EP disclosed
EP-2295503-A1 Dibenzorhodamine dyes useful as fluorescent labelling agents Applera Corporation (US) 2011-03-16 — — EP disclosed
EP-2186801-A2 Intermediates for synthesizing dibenzorhodamine dyes Applera Corporation (US) 2010-05-19 — — EP disclosed
US-20070099210-A1 Methods of Labelling Polynucleotides with Dibenzorhodamine Dyes APPLERA CORPORATION (US) 2007-05-03 — — 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-20070099210-A1 Methods of Labelling Polynucleotides with Dibenzorhodamine Dyes NUDT1, DUT, NSUN3 PGR 2933/4885ALDH1A1 1645/4885POLB 62/4885

“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.

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