SCHEMBL24096202

SCHEMBL24096202

CCCCCCNC(=O)NCC(=O)N(C)CCc1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 1/20 0.53
▸ EPHX1 P07099 7/20 0.51
▸ ALDH1A1 P00352 1/20 0.51
▸ HTT P42858 1/20 0.51
▸ KMT2A Q03164 2/20 0.47
▸ EPHX2 P34913 4/20 0.47
▸ NAAA Q02083 1/20 0.47
▸ TMEM97 Q5BJF2 1/20 0.46
▸ SIGMAR1 Q99720 1/20 0.46
▸ THRA P10827 1/20 0.46
▸ THRB P10828 1/20 0.46

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
SCHEMBL8507635 0.81 HPGD (0.68) HPGDEPHX1ALDH1A1HTTKMT2A
SCHEMBL24095849 0.81 NPC1 (0.51) THRATHRB
SCHEMBL24095812 0.80 HPGD (0.66) HPGDEPHX1ALDH1A1HTTEPHX2
SCHEMBL24096055 0.79 HPGD (0.60) HPGDEPHX1ALDH1A1HTTKMT2A
SCHEMBL24095827 0.78 HPGD (0.56) HPGDEPHX1ALDH1A1HTTEPHX2
SCHEMBL10014325 0.78 NPC1 (0.57) HPGDEPHX1ALDH1A1HTTKMT2A
SCHEMBL24095847 0.77 SIGMAR1 (0.67) HPGDEPHX1ALDH1A1HTTEPHX2
SCHEMBL16270338 0.77 SMN1; SMN2 (0.65) HPGDEPHX1ALDH1A1KMT2AEPHX2
SCHEMBL11035774 0.76 EPHX2 (0.69) HPGDEPHX1ALDH1A1HTTEPHX2
SCHEMBL7426776 0.76 KMT2A (0.57) KMT2ATHRATHRB

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-2021252640-A1 ASPARAGINE DERIVATIVES AND METHODS OF USING SAME SENDA BIOSCIENCES, INC. (US) 2021-12-16 — — WO disclosed
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