SCHEMBL22102729

SCHEMBL22102729

C[n+]1ccn(CCCNc2ccc(Nc3cc(Nc4ccccc4)c(N)cc3N)cc2)c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.36
MEN1 O00255 5/20 0.36
KMT2A Q03164 5/20 0.36
HTT P42858 3/20 0.36
SMN1; SMN2 Q16637 3/20 0.36
NPC1 O15118 2/20 0.36
RAB9A P51151 2/20 0.36
APAF1 O14727 1/20 0.36
PLA2G1B P04054 1/20 0.36
HSP90AA1 P07900 1/20 0.36
MAPK1 P28482 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
ATG4B Q9Y4P1 1/20 0.36
KDM4E B2RXH2 6/20 0.34
GAA P10253 5/20 0.34
LMNA P02545 3/20 0.34
HPGD P15428 2/20 0.34
ALDH1A1 P00352 6/20 0.34
ALOX15 P16050 1/20 0.34
GFER P55789 2/20 0.34

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
SCHEMBL20288337 0.96 MEN1 (0.39) MAPTMEN1KMT2AHTTSMN1; SMN2
SCHEMBL20267791 0.92 MAPT (0.36) MAPTMEN1KMT2AHTTSMN1; SMN2
SCHEMBL20268996 0.92 MEN1 (0.40) MAPTMEN1KMT2AHTTSMN1; SMN2
SCHEMBL20267798 0.90 MEN1 (0.35) MAPTMEN1KMT2AHTTSMN1; SMN2
SCHEMBL20280485 0.88 MEN1 (0.35) MAPTMEN1KMT2AHTTSMN1; SMN2
SCHEMBL22102730 0.87 MAPKAPK2 (0.36) MAPTMEN1KMT2AHTTSMN1; SMN2
SCHEMBL20280488 0.86 MEN1 (0.34) MAPTMEN1KMT2AHTTSMN1; SMN2
SCHEMBL22699842 0.84 MEN1 (0.31) MAPTMEN1KMT2AHTTSMN1; SMN2
SCHEMBL22701347 0.84 MEN1 (0.32) MAPTMEN1KMT2AHTTSMN1; SMN2
SCHEMBL24348970 0.82 QPCT (0.33) MAPTMEN1KMT2AHTTSMN1; SMN2

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 MAPT 862/4885MEN1 422/4885KMT2A 1199/4885
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 MAPT 862/4885MEN1 422/4885KMT2A 1199/4885

“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.