SCHEMBL24176160

SCHEMBL24176160

CCCCCCNC(=O)N1CCN(C(=O)NCCCCCC)CC1

nearest known ligand 0.65

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.65
HTT P42858 2/20 0.64
NAMPT P43490 2/20 0.61
EPHX1 P07099 6/20 0.57
KMT2A Q03164 2/20 0.57
CASP2 P42575 1/20 0.57
MEN1 O00255 1/20 0.54
CNR1 P21554 1/20 0.54
CNR2 P34972 1/20 0.54
NAAA Q02083 1/20 0.53
POLB P06746 1/20 0.52
MAPK1 P28482 1/20 0.52
GAA P10253 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49

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
SCHEMBL10739048 1.00 TDP1 (0.65) TDP1HTTNAMPTEPHX1KMT2A
SCHEMBL4285086 1.00 TDP1 (0.65) TDP1HTTNAMPTEPHX1KMT2A
SCHEMBL28165171 1.00 TDP1 (0.65) TDP1HTTNAMPTEPHX1KMT2A
SCHEMBL10739485 1.00 TDP1 (0.65) TDP1HTTNAMPTEPHX1KMT2A
SCHEMBL28273729 1.00 TDP1 (0.65) TDP1HTTNAMPTEPHX1KMT2A
SCHEMBL10520613 0.93 NAMPT (0.59) TDP1HTTNAMPTEPHX1KMT2A
SCHEMBL15134825 0.93 NAMPT (0.59) TDP1HTTNAMPTEPHX1KMT2A
SCHEMBL8393260 0.92 HTT (0.60) TDP1HTTNAMPTEPHX1KMT2A
SCHEMBL8391321 0.92 HTT (0.60) TDP1HTTNAMPTEPHX1KMT2A
SCHEMBL8395941 0.92 HTT (0.60) TDP1HTTNAMPTEPHX1KMT2A

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230272148-A1 THERMOPLASTIC POLY(URETHANE-UREA) POLYADDUCTS TECHNISCHE UNIVERSITAET WIEN (AT) 2023-08-31 US disclosed
US-20230272148-A1 THERMOPLASTIC POLY(URETHANE-UREA) POLYADDUCTS TECHNISCHE UNIVERSITAET WIEN (AT) 2023-08-31 US disclosed
WO-2022003204-A1 THERMOPLASTIC POLY(URETHANE-UREA) POLYADDUCTS TECHNISCHE UNIVERSITÄT WIEN (AT) 2022-01-06 WO disclosed