SCHEMBL17845668

SCHEMBL17845668

Fc1ccc(NC2CCO[CH]C2Cl)c(F)c1F

nearest known ligand 0.35

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 6/20 0.35
LMNA P02545 1/20 0.34
ALDH1A1 P00352 1/20 0.32

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
SCHEMBL17845473 0.87 TP53 (0.33)
SCHEMBL17845614 0.81 GAA (0.40) EPHX2ALDH1A1
SCHEMBL17845724 0.77 RAB9A (0.38) LMNAALDH1A1
SCHEMBL17845696 0.74 DDB1 (0.35) LMNAALDH1A1
SCHEMBL17845619 0.73 KMT2A (0.43) ALDH1A1
SCHEMBL17845622 0.72 SMN1; SMN2 (0.40) LMNAALDH1A1
SCHEMBL17845520 0.71 KMT2A (0.39) LMNA
SCHEMBL17845596 0.70 KDM4E (0.41) EPHX2
SCHEMBL17845599 0.69 MEN1 (0.33)
SCHEMBL9847935 0.68 EPHX2 (0.49) EPHX2LMNAALDH1A1

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