SCHEMBL14339652

SCHEMBL14339652

CC(C)(C)OC(=O)N1CCCC(c2cc(-c3ccccc3CCc3ccccc3)nc(N)c2CO)C1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRMT5 O14744 2/20 0.41
USP30 Q70CQ3 2/20 0.41
TRPV3 Q8NET8 2/20 0.40
ALOX5AP P20292 2/20 0.40
FEN1 P39748 2/20 0.40
SMARCA2 P51531 2/20 0.39
SMARCA4 P51532 2/20 0.39
PBRM1 Q86U86 2/20 0.39
HPGDS O60760 1/20 0.39
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
GLA P06280 1/20 0.39
HPGD P15428 1/20 0.39
RECQL P46063 1/20 0.39
HSD17B10 Q99714 1/20 0.39
EGFR P00533 1/20 0.38
SRC P12931 1/20 0.38
IKBKB O14920 1/20 0.38
ACKR3 P25106 1/20 0.37
JAK2 O60674 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
SCHEMBL14339641 0.89 PRMT5 (0.41) PRMT5USP30TRPV3ALOX5APFEN1
SCHEMBL14339627 0.89 PRMT5 (0.41) PRMT5USP30TRPV3ALOX5APFEN1
SCHEMBL14339748 0.88 USP30 (0.42) PRMT5USP30TRPV3ALOX5APFEN1
SCHEMBL4947268 0.88 SMARCA2 (0.51) PRMT5USP30TRPV3ALOX5APFEN1
SCHEMBL14339706 0.88 TRPV3 (0.41) PRMT5USP30TRPV3ALOX5APFEN1
SCHEMBL14339715 0.87 PRMT5 (0.42) PRMT5USP30TRPV3ALOX5APFEN1
SCHEMBL4939836 0.87 PRMT5 (0.47) PRMT5USP30TRPV3ALOX5APFEN1
SCHEMBL7015204 0.83 SMARCA2 (0.49) PRMT5USP30TRPV3ALOX5APFEN1
SCHEMBL14339743 0.83 USP30 (0.42) PRMT5USP30TRPV3ALOX5APFEN1
SCHEMBL7019154 0.82 PRMT5 (0.46) PRMT5USP30TRPV3ALOX5APFEN1

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
EP-1326856-B1 PYRIDINE DERIVATIVES WITH IKB-KINASE (IKK-BETA) INHIBITING ACTIVITY BAYER HEALTHCARE AG (DE) 2007-12-19 EP disclosed