SCHEMBL17845599

SCHEMBL17845599

Clc1cc(Cl)cc(NC2CCO[CH]C2Cl)c1

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
MAPT P10636 1/20 0.31
GAA P10253 1/20 0.31
GRM4 Q14833 1/20 0.30

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
SCHEMBL17845686 0.84 FADS1 (0.43) MEN1KMT2AMAPT
SCHEMBL17845622 0.83 SMN1; SMN2 (0.40) GAA
SCHEMBL17845759 0.75 ALDH1A1 (0.35) MEN1KMT2AMAPTGAA
SCHEMBL17845629 0.75 DDB1 (0.35)
SCHEMBL17845696 0.75 DDB1 (0.35) MEN1KMT2AMAPTGAA
SCHEMBL17845724 0.75 RAB9A (0.38) MEN1KMT2AMAPT
SCHEMBL17845543 0.75 DDB1 (0.39) MEN1KMT2AMAPTGAA
SCHEMBL17845655 0.74 TSHR (0.37) MEN1KMT2AMAPT
SCHEMBL17845596 0.74 KDM4E (0.41) MEN1KMT2AMAPTGAA
SCHEMBL17845619 0.71 KMT2A (0.43) MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3233860-A1 SUBSTITUTED 6-ANILINO-9-HETEROCYCLYLPURINE DERIVATIVES FOR INHIBITION OF PLANT STRESS Univerzita Palackého V Olomouci (CZ) 2017-10-25 EP disclosed
WO-2016095881-A1 SUBSTITUTED 6-ANILINO-9-HETEROCYCLYLPURINE DERIVATIVES FOR INHIBITION OF PLANT STRESS UNIVERZITA PALACKEHO V OLOMOUCI (CZ) 2016-06-23 WO disclosed