SCHEMBL15020213

SCHEMBL15020213

COC1=C(Nc2ccc(N)cc2)/C(=N\c2ccc(N)cc2)C=C(Nc2ccc(N)cc2)C1=O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ IDO1 P14902 4/20 0.45
▸ NR4A1 P22736 1/20 0.39
▸ MAPT P10636 10/20 0.38
▸ L3MBTL1 Q9Y468 9/20 0.38
▸ ALDH1A1 P00352 8/20 0.38
▸ MAPK1 P28482 7/20 0.38
▸ LMNA P02545 6/20 0.38
▸ RAB9A P51151 6/20 0.38
▸ HPGD P15428 5/20 0.38
▸ KDM4E B2RXH2 5/20 0.38
▸ HTT P42858 5/20 0.38
▸ POLB P06746 4/20 0.38
▸ SMN1; SMN2 Q16637 4/20 0.38
▸ NPC1 O15118 4/20 0.38
▸ TDP1 Q9NUW8 3/20 0.38
▸ RECQL P46063 2/20 0.38
▸ NSD2 O96028 2/20 0.38
▸ GLA P06280 1/20 0.38
▸ MEN1 O00255 4/20 0.38
▸ KMT2A Q03164 4/20 0.38

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
SCHEMBL15020218 1.00 IDO1 (0.45) IDO1NR4A1MAPTL3MBTL1ALDH1A1
SCHEMBL16426689 0.88 IDO1 (0.43) IDO1NR4A1MAPTL3MBTL1ALDH1A1
SCHEMBL15019822 0.87 MAPT (0.52) IDO1MAPTL3MBTL1ALDH1A1MAPK1
SCHEMBL15019818 0.87 MAPT (0.52) IDO1MAPTL3MBTL1ALDH1A1MAPK1
SCHEMBL15019799 0.81 IDO1 (0.40) IDO1MAPTL3MBTL1ALDH1A1MAPK1
SCHEMBL15019795 0.81 IDO1 (0.40) IDO1MAPTL3MBTL1ALDH1A1MAPK1
SCHEMBL15020330 0.79 IDO1 (0.39) IDO1MAPTL3MBTL1ALDH1A1MAPK1
SCHEMBL15019794 0.79 IDO1 (0.39) IDO1MAPTL3MBTL1ALDH1A1MAPK1
SCHEMBL16426683 0.77 RAB9A (0.48) IDO1MAPTL3MBTL1ALDH1A1MAPK1
SCHEMBL1146673 0.75 APAF1 (0.37) NR4A1MAPTL3MBTL1ALDH1A1MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2791252-A1 TRIAROMATIC AZOMETHINE DIRECT DYES, DYE COMPOSITION COMPRISING AT LEAST ONE SUCH DYE, METHOD OF IMPLEMENTATION AND USE L'OREAL (FR) 2014-10-22 — — EP claimed
WO-2013087768-A1 TRIAROMATIC AZOMETHINE DIRECT DYES, DYE COMPOSITION COMPRISING AT LEAST ONE SUCH DYE, METHOD OF IMPLEMENTATION AND USE L'OREAL (FR) 2013-06-20 — — WO claimed
US-9554977-B2 Triaromatic azomethine direct dyes, dye composition comprising at least one such dye, method of implementation and use L'OREAL (FR) 2017-01-31 — — US disclosed
US-20150320660-A1 TRIAROMATIC AZOMETHINE DIRECT DYES, DYE COMPOSITION COMPRISING AT LEAST ONE SUCH DYE, METHOD OF IMPLEMENTATION AND USE L'OREAL (FR) 2015-11-12 — — US disclosed
WO-2013087768-A1 TRIAROMATIC AZOMETHINE DIRECT DYES, DYE COMPOSITION COMPRISING AT LEAST ONE SUCH DYE, METHOD OF IMPLEMENTATION AND USE 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-20150320660-A1 TRIAROMATIC AZOMETHINE DIRECT DYES, DYE COMPOSITION COMPRISING AT LEAST ONE SUCH DYE, METHOD OF IMPLEMENTATION AND USE KRT18, MKI67, CDC73 IDO1 238/4885NR4A1 2117/4885MAPT 469/4885

“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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