SCHEMBL18526705

SCHEMBL18526705

COCCCC(=O)N1CCCC1

nearest known ligand 0.65

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.65
L3MBTL1 Q9Y468 2/20 0.60
KMT2A Q03164 5/20 0.58
MEN1 O00255 4/20 0.58
TDP1 Q9NUW8 1/20 0.58
HPGD P15428 6/20 0.54
RAB9A P51151 3/20 0.54
SMN1; SMN2 Q16637 3/20 0.54
NPC1 O15118 3/20 0.54
ALDH1A1 P00352 3/20 0.51
NPSR1 Q6W5P4 2/20 0.51
HTT P42858 1/20 0.51
MAPT P10636 1/20 0.51
TSHR P16473 1/20 0.51
GLA P06280 1/20 0.46
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 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
SCHEMBL4440119 0.91 KMT2A (0.62) ATML3MBTL1KMT2AMEN1TDP1
SCHEMBL10404896 0.88 ATM (0.58) ATML3MBTL1KMT2AMEN1TDP1
SCHEMBL12518836 0.86 HPGD (0.58) ATML3MBTL1KMT2AMEN1TDP1
SCHEMBL27294527 0.85 ATM (0.45) ATML3MBTL1KMT2AMEN1TDP1
SCHEMBL12282233 0.85 KMT2A (0.52) ATML3MBTL1KMT2AMEN1TDP1
SCHEMBL4297608 0.83 GNAI3 (0.44) ATML3MBTL1KMT2AMEN1TDP1
SCHEMBL22336795 0.83 ATM (0.53) ATML3MBTL1KMT2AMEN1TDP1
SCHEMBL2606049 0.82 NPC1 (0.73) ATMKMT2AMEN1HPGDRAB9A
SCHEMBL13535832 0.80 ATM (0.41) ATML3MBTL1KMT2AMEN1TDP1
SCHEMBL25030390 0.79 HPGD (0.53) ATML3MBTL1KMT2AMEN1TDP1

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
WO-2023002165-A1 INHIBITOR COMPOUNDS Neophore Limited (GB) 2023-01-26 WO disclosed
EP-2499132-B1 HEPATITIS C VIRUS INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2017-02-15 EP disclosed