SCHEMBL15020967

SCHEMBL15020967

CCN(CCO)C1=CC(=O)C(Nc2ccc(N)c(OC)c2)=CC1=O

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 3/20 0.33
▸ KDR P35968 2/20 0.33
▸ DNM1 Q05193 1/20 0.32
▸ CSF1R P07333 1/20 0.32
▸ ALDH1A1 P00352 5/20 0.32
▸ GAA P10253 2/20 0.31
▸ HTT P42858 1/20 0.31
▸ NPSR1 Q6W5P4 1/20 0.31
▸ TSHR P16473 2/20 0.31
▸ THRB P10828 2/20 0.31
▸ HTR3E A5X5Y0 1/20 0.31
▸ SLC22A1 O15245 1/20 0.31
▸ HTR3B O95264 1/20 0.31
▸ LMNA P02545 1/20 0.31
▸ MPO P05164 1/20 0.31
▸ CYP1A2 P05177 1/20 0.31
▸ ADRA2A P08913 1/20 0.31
▸ CYP2D6 P10635 1/20 0.31
▸ DRD2 P14416 1/20 0.31
▸ ADRA2C P18825 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
SCHEMBL15039377 0.88 KDR (0.36) MAPTKDRDNM1CSF1RALDH1A1
SCHEMBL15039277 0.86 ALDH1A1 (0.39) MAPTDNM1ALDH1A1GAATSHR
SCHEMBL15020510 0.82 DNM1 (0.41) MAPTDNM1ALDH1A1GAAHTT
SCHEMBL15020242 0.80 KDR (0.34) MAPTKDRALDH1A1NPSR1TSHR
SCHEMBL15020301 0.79 DNM1 (0.56) MAPTDNM1ALDH1A1GAAHTT
SCHEMBL15039427 0.79 DNM1 (0.42) MAPTDNM1ALDH1A1GAAHTT
SCHEMBL15039426 0.78 DNM1 (0.37) MAPTDNM1ALDH1A1GAATSHR
SCHEMBL15020267 0.76 — —
SCHEMBL15039273 0.74 S100B (0.31) —
SCHEMBL15039275 0.73 ALDH1A1 (0.42) DNM1ALDH1A1TSHRTHRBCYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2791106-B1 PARTICULAR QUINONE DIRECT DYES, DYE COMPOSITION COMPRISING AT LEAST ONE SUCH DYE, IMPLEMENTATION PROCESS THEREFOR AND USE THEROF OREAL (FR) 2016-05-18 — — EP claimed
EP-2791106-A1 PARTICULAR QUINONE DIRECT DYES, DYE COMPOSITION COMPRISING AT LEAST ONE SUCH DYE, IMPLEMENTATION PROCESS THEREFOR AND USE THEREOF L'OREAL (FR) 2014-10-22 — — EP claimed
WO-2013087770-A1 PARTICULAR QUINONE DIRECT DYES, DYE COMPOSITION COMPRISING AT LEAST ONE SUCH DYE, IMPLEMENTATION PROCESS THEREFOR AND USE THEREOF L'OREAL (FR) 2013-06-20 — — WO claimed
EP-2791106-B1 PARTICULAR QUINONE DIRECT DYES, DYE COMPOSITION COMPRISING AT LEAST ONE SUCH DYE, IMPLEMENTATION PROCESS THEREFOR AND USE THEROF OREAL (FR) 2016-05-18 — — EP disclosed
EP-2791106-B1 PARTICULAR QUINONE DIRECT DYES, DYE COMPOSITION COMPRISING AT LEAST ONE SUCH DYE, IMPLEMENTATION PROCESS THEREFOR AND USE THEROF OREAL (FR) 2016-05-18 — — EP disclosed
US-9233057-B2 Particular quinone direct dyes, dye composition comprising at least one such dye, implementation process therefor and use thereof L'OREAL (FR) 2016-01-12 — — US disclosed
US-20140360523-A1 PARTICULAR QUINONE DIRECT DYES, DYE COMPOSITION COMPRISING AT LEAST ONE SUCH DYE, IMPLEMENTATION PROCESS THEREFOR AND USE THEREOF L'OREAL (FR) 2014-12-11 — — US disclosed
WO-2013087770-A1 PARTICULAR QUINONE DIRECT DYES, DYE COMPOSITION COMPRISING AT LEAST ONE SUCH DYE, IMPLEMENTATION PROCESS THEREFOR AND USE THEREOF L'OREAL (FR) 2013-06-20 — — WO 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-20140360523-A1 PARTICULAR QUINONE DIRECT DYES, DYE COMPOSITION COMPRISING AT LEAST ONE SUCH DYE, IMPLEMENTATION PROCESS THEREFOR AND USE THEREOF KRT18, SQOR, NDUFB7 MAPT 255/4885KDR 3778/4885DNM1 961/4885

“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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