SCHEMBL22102774

SCHEMBL22102774

CCOc1ccc(Nc2cc(Nc3ccccc3)c(N)cc2N)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.50
MAPT P10636 6/20 0.50
KDM4E B2RXH2 5/20 0.50
HTT P42858 4/20 0.50
RAB9A P51151 3/20 0.50
ALDH1A1 P00352 3/20 0.50
HPGD P15428 3/20 0.50
NPC1 O15118 2/20 0.50
L3MBTL1 Q9Y468 2/20 0.50
PKM P14618 1/20 0.50
POLB P06746 1/20 0.50
OPRM1 P35372 1/20 0.50
OPRD1 P41143 1/20 0.50
RAD52 P43351 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50
CTDSP1 Q9GZU7 1/20 0.49
SLC2A1 P11166 1/20 0.49
P2RY2 P41231 1/20 0.47
LTA4H P09960 1/20 0.46
MEN1 O00255 4/20 0.46

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
SCHEMBL20269580 0.94 CTDSP1 (0.54) KMT2AMAPTKDM4EHTTRAB9A
SCHEMBL22701374 0.90 KMT2A (0.45) KMT2AMAPTKDM4EHTTRAB9A
SCHEMBL22102773 0.89 TSHR (0.59) KMT2AMAPTKDM4EHTTRAB9A
SCHEMBL22683204 0.89 CTDSP1 (0.55) KMT2AMAPTKDM4EHTTRAB9A
SCHEMBL11352030 0.86 GAA (0.49) KMT2AMAPTKDM4EHTTRAB9A
SCHEMBL7987956 0.86 KMT2A (0.49) KMT2AMAPTKDM4EHTTRAB9A
SCHEMBL5832931 0.83 MAPT (0.66) KMT2AMAPTKDM4EHTTRAB9A
SCHEMBL22102727 0.82 ALDH1A1 (0.50) KMT2AMAPTKDM4EHTTRAB9A
SCHEMBL4931897 0.82 KDM4E (0.50) KMT2AMAPTKDM4EHTTRAB9A
SCHEMBL9479637 0.82 MAPT (0.63) KMT2AMAPTKDM4EHTTRAB9A

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-3554466-B1 DISSYMMETRIC AZOMETHINE DIRECT DYES AND PROCESS FOR THEIR PREPARATION, COSMETIC COMPOSITION COMPRISING AT LEAST ONE SUCH DYE AND USE THEREOF OREAL (FR) 2020-11-25 EP claimed
US-10927259-B2 Dissymmetric azomethine direct dyes and process for their preparation, cosmetic composition comprising at least one such dye and use thereof L'OREAL (FR) 2021-02-23 US disclosed
EP-3554466-B1 DISSYMMETRIC AZOMETHINE DIRECT DYES AND PROCESS FOR THEIR PREPARATION, COSMETIC COMPOSITION COMPRISING AT LEAST ONE SUCH DYE AND USE THEREOF OREAL (FR) 2020-11-25 EP disclosed
EP-3554466-B1 DISSYMMETRIC AZOMETHINE DIRECT DYES AND PROCESS FOR THEIR PREPARATION, COSMETIC COMPOSITION COMPRISING AT LEAST ONE SUCH DYE AND USE THEREOF OREAL (FR) 2020-11-25 EP disclosed
US-20200190329-A1 DISSYMMETRIC AZOMETHINE DIRECT DYES AND PROCESS FOR THEIR PREPARATION, COSMETIC COMPOSITION COMPRISING AT LEAST ONE SUCH DYE AND USE THEREOF L'OREAL (FR) 2020-06-18 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 (2 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-10927259-B2 Dissymmetric azomethine direct dyes and process for their preparation, cosmetic composition comprising at least one such dye and use thereof KRT18, DSG1, IK KMT2A 1199/4885MAPT 862/4885KDM4E 795/4885
US-20200190329-A1 DISSYMMETRIC AZOMETHINE DIRECT DYES AND PROCESS FOR THEIR PREPARATION, COSMETIC COMPOSITION COMPRISING AT LEAST ONE SUCH DYE AND USE THEREOF KRT18, DSG1, IK KMT2A 1199/4885MAPT 862/4885KDM4E 795/4885

“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.