SCHEMBL14467701

SCHEMBL14467701

COCCCNN1CCOCC1

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.41
KDM4E B2RXH2 3/20 0.39
HTT P42858 1/20 0.37
MAPT P10636 1/20 0.37
KDM1A O60341 1/20 0.36
KMT2A Q03164 1/20 0.35
GLA P06280 1/20 0.34
ALDH1A1 P00352 3/20 0.33
GAA P10253 2/20 0.33
GNAI3 P08754 1/20 0.33
GNAO1 P09471 1/20 0.33
GNAI1 P63096 1/20 0.33
HTR4 Q13639 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
TSHR P16473 1/20 0.32
CYP3A4 P08684 1/20 0.32

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
SCHEMBL13451264 0.88 TDP1 (0.47) TDP1KDM4EHTTMAPTKDM1A
SCHEMBL13451265 0.80 GAA (0.39) TDP1KDM4EMAPTALDH1A1GAA
SCHEMBL4721218 0.78 HTT (0.49) HTTKDM1AALDH1A1GNAI3GNAO1
SCHEMBL3699860 0.77 KDM1A (0.33) TDP1HTTKDM1AGLAGNAI3
SCHEMBL3712866 0.77 HTR4 (0.34) TDP1HTTKDM1AGLAALDH1A1
SCHEMBL13567506 0.76 KDM1A (0.37) HTTKDM1AGNAI3GNAO1GNAI1
Hydrazine SCHEMBL8557171 0.74 HTT (0.46) HTTKDM1AALDH1A1GNAI3GNAO1
SCHEMBL28245251 0.74 GNAI3 (0.59) HTTKDM1AKMT2AALDH1A1GNAI3
SCHEMBL9126435 0.74 KDM1A (0.38) HTTKDM1AGNAI3GNAO1GNAI1
Bromide SCHEMBL28507361 0.73 GNAI3 (0.58) HTTKDM1AKMT2AALDH1A1GNAI3

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-2007084413-A2 METHODS FOR TREATING HEPATITIS C PTC THERAPEUTICS, INC. (US) 2007-07-26 WO disclosed