SCHEMBL17845696

SCHEMBL17845696

Fc1ccc(NC2CCO[CH]C2Cl)cc1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DDB1 Q16531 1/20 0.35
CRBN Q96SW2 1/20 0.35
POLB P06746 1/20 0.34
TRPA1 O75762 2/20 0.33
RAB9A P51151 2/20 0.33
NPC1 O15118 1/20 0.33
ESR1 P03372 1/20 0.33
PGR P06401 1/20 0.33
HTR2A P28223 1/20 0.33
SLC6A3 Q01959 1/20 0.33
TRPC5 Q9UL62 1/20 0.33
F2R P25116 1/20 0.31
CAPN1 P07384 1/20 0.30
LMNA P02545 2/20 0.30
MEN1 O00255 1/20 0.30
ALDH1A1 P00352 1/20 0.30
CYP1A2 P05177 1/20 0.30
CYP3A4 P08684 1/20 0.30
GAA P10253 1/20 0.30
MAPT P10636 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
SCHEMBL17845622 0.85 SMN1; SMN2 (0.40) POLBTRPA1RAB9ANPC1LMNA
SCHEMBL17845759 0.84 ALDH1A1 (0.35) MEN1ALDH1A1GAAMAPTKMT2A
SCHEMBL17845629 0.84 DDB1 (0.35) DDB1CRBN
SCHEMBL17845760 0.83 ALDH1A1 (0.40) DDB1CRBNLMNAALDH1A1GAA
SCHEMBL17845778 0.82 DDB1 (0.36) DDB1CRBNPOLBTRPA1RAB9A
SCHEMBL17845596 0.82 KDM4E (0.41) TRPA1RAB9ANPC1MEN1GAA
SCHEMBL17845579 0.81 DDB1 (0.35) DDB1CRBNPOLBTRPA1RAB9A
SCHEMBL17845612 0.80 HPGD (0.38) POLBRAB9ANPC1ALDH1A1GAA
SCHEMBL17845599 0.75 MEN1 (0.33) MEN1GAAMAPTKMT2A
SCHEMBL17845614 0.75 GAA (0.40) DDB1CRBNPOLBRAB9ANPC1

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