SCHEMBL38658697

SCHEMBL38658697

O=C(Nc1ccc(-c2ccccc2)cc1)N1CCCN1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.51
ALDH1A1 P00352 4/20 0.50
MAPT P10636 3/20 0.50
GAA P10253 1/20 0.50
EPHX2 P34913 1/20 0.49
PTPN1 P18031 2/20 0.47
PTPN11 Q06124 1/20 0.47
HDAC3 O15379 1/20 0.47
HDAC1 Q13547 1/20 0.47
HDAC2 Q92769 1/20 0.47
FAAH O00519 1/20 0.47
DHODH Q02127 1/20 0.46
RAB9A P51151 4/20 0.44
LMNA P02545 1/20 0.44
NPC1 O15118 3/20 0.44
SMN1; SMN2 Q16637 3/20 0.44
MITF O75030 1/20 0.44
HTT P42858 1/20 0.44
ALOX15 P16050 1/20 0.43
TSHR P16473 1/20 0.43

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
SCHEMBL13787488 0.91 POLB (0.61) POLBALDH1A1MAPTGAAHDAC3
SCHEMBL38656601 0.88 KLK5 (0.46) POLBALDH1A1MAPTGAAEPHX2
SCHEMBL6109583 0.86 POLB (0.59) POLBALDH1A1MAPTGAAFAAH
SCHEMBL4954488 0.84 POLB (0.58) POLBALDH1A1MAPTGAARAB9A
SCHEMBL4449787 0.81 LMNA (0.50) MAPTGAAEPHX2RAB9ALMNA
SCHEMBL7320026 0.80 POLB (0.79) POLBALDH1A1MAPTGAAEPHX2
SCHEMBL11668917 0.77 LMNA (0.49) MAPTGAARAB9ALMNANPC1
SCHEMBL10671305 0.77 KMT2A (0.62) POLBALDH1A1MAPTRAB9ANPC1
SCHEMBL14665150 0.75 RAB9A (0.48) POLBALDH1A1MAPTGAAHDAC3
SCHEMBL4729692 0.74 MEN1 (0.49) POLBALDH1A1MAPTGAARAB9A

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
WO-2026102082-A1 ALKYLPHENYL SUBSTITUTED COMPOUNDS, COMPOSITIONS AND METHODS OF USE DEEP APPLE THERAPEUTICS, INC. (US) 2026-05-15 WO disclosed