SCHEMBL21242322

SCHEMBL21242322

Clc1ccc(/N=N/c2ccc(NCCNc3ccc(/N=N/c4ccc(Cl)cc4)cc3)cc2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 9/20 0.43
MEN1 O00255 7/20 0.43
KMT2A Q03164 7/20 0.43
ALDH1A1 P00352 3/20 0.41
KDM4E B2RXH2 2/20 0.41
LMNA P02545 1/20 0.41
HTT P42858 1/20 0.41
GAA P10253 4/20 0.40
RHOC P08134 1/20 0.38
RHOA P61586 1/20 0.38
CYP2C19 P33261 3/20 0.38
RAB9A P51151 3/20 0.38
CYP1A2 P05177 2/20 0.38
CYP2C9 P11712 2/20 0.38
NPC1 O15118 1/20 0.38
RECQL P46063 1/20 0.38
DRD2 P14416 1/20 0.38
DRD4 P21917 1/20 0.38
CA12 O43570 1/20 0.38
CA2 P00918 1/20 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
SCHEMBL9639726 0.86 MAPT (0.55) MAPTMEN1KMT2AALDH1A1LMNA
SCHEMBL21242324 0.80 MAPT (0.44) MAPTMEN1KMT2AALDH1A1KDM4E
SCHEMBL21242326 0.78 MAPT (0.61) MAPTMEN1KMT2AALDH1A1KDM4E
SCHEMBL3282369 0.78 LMNA (0.57) MAPTMEN1KMT2AALDH1A1KDM4E
SCHEMBL3282366 0.78 LMNA (0.57) MAPTMEN1KMT2AALDH1A1KDM4E
SCHEMBL11528235 0.77 MAPT (0.58) MAPTMEN1KMT2AALDH1A1KDM4E
SCHEMBL11526668 0.76 MAPT (0.77) MAPTMEN1KMT2AALDH1A1LMNA
SCHEMBL21242505 0.75 GRIN2D (0.47) MAPTMEN1KMT2AALDH1A1LMNA
SCHEMBL1947326 0.75 MEN1 (0.47) MAPTMEN1KMT2AALDH1A1LMNA
SCHEMBL3029679 0.75 MEN1 (0.47) MAPTMEN1KMT2AALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3412734-B1 DYE COMPOUND, COMPOSITION COMPRISING THE DYE COMPOUND, AND DISPLAY DEVICE USING THE DYE COMPOUND SAMSUNG DISPLAY CO LTD (KR) 2019-08-07 EP disclosed