SCHEMBL24373569

SCHEMBL24373569

CN1CCN(CCCCCCNC=O)CC1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PAOX Q6QHF9 2/20 0.50
ADH1B P00325 3/20 0.47
ADH1A P07327 3/20 0.47
ADH7 P40394 3/20 0.47
ADH1C P00326 2/20 0.47
EPHX1 P07099 1/20 0.47
ADH4 P08319 1/20 0.47
GNAI3 P08754 2/20 0.41
GNAO1 P09471 2/20 0.41
GNAI1 P63096 2/20 0.41
SIGMAR1 Q99720 1/20 0.40
MEN1 O00255 1/20 0.38
ALDH1A1 P00352 1/20 0.38
RAD52 P43351 1/20 0.38
KMT2A Q03164 1/20 0.38
HDAC2 Q92769 1/20 0.37
HDAC8 Q9BY41 1/20 0.37
HDAC6 Q9UBN7 1/20 0.37
HTR7 P34969 1/20 0.37
HRH3 Q9Y5N1 1/20 0.37

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
SCHEMBL2183070 0.94 ADH1B (0.45) PAOXADH1BADH1AADH7ADH1C
SCHEMBL1785087 0.86 GNAI3 (0.44) PAOXADH1BADH1AADH7ADH1C
SCHEMBL20407305 0.86
SCHEMBL16207271 0.86 ADH1B (0.46) PAOXADH1BADH1AADH7ADH1C
SCHEMBL1781619 0.82 HRH3 (0.52) ADH1BADH1AADH7ADH1CEPHX1
SCHEMBL4392290 0.81 PAOX (0.48) PAOXGNAI3GNAO1GNAI1SIGMAR1
SCHEMBL3931949 0.81 ADH1B (0.48) PAOXADH1BADH1AADH7ADH1C
SCHEMBL3950791 0.81 ADH1B (0.54) PAOXADH1BADH1AADH7ADH1C
SCHEMBL23259267 0.81 PAOX (0.42) PAOXGNAI3GNAO1GNAI1SIGMAR1
SCHEMBL13527580 0.80 HRH3 (0.56) ADH1BADH1AADH7ADH1CEPHX1

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-2022087216-A1 DOUBLE DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. (US) 2022-04-28 WO disclosed