SCHEMBL31432279

SCHEMBL31432279

O=C(O)c1cccc(N2CCCCC2)n1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 6/20 0.61
GNE Q9Y223 1/20 0.58
HSD17B14 Q9BPX1 1/20 0.56
KDM4E B2RXH2 2/20 0.53
ALOX15 P16050 1/20 0.53
TSHR P16473 1/20 0.53
ACMSD Q8TDX5 1/20 0.53
TDP1 Q9NUW8 1/20 0.53
CNR1 P21554 1/20 0.46
ALDH1A1 P00352 2/20 0.44
HPGD P15428 2/20 0.44
POLB P06746 1/20 0.44
ALOX12 P18054 1/20 0.44
PRKCQ Q04759 3/20 0.44
PRKCA P17252 2/20 0.44
PRKCD Q05655 2/20 0.44
TTR P02766 1/20 0.44
MEN1 O00255 1/20 0.44
GAA P10253 1/20 0.44
KMT2A Q03164 1/20 0.44

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
SCHEMBL1781915 1.00 HSD11B1 (0.61) HSD11B1GNEHSD17B14KDM4EALOX15
SCHEMBL836939 0.98 GNE (0.60) HSD11B1GNEHSD17B14KDM4EALOX15
SCHEMBL14879835 0.95 GNE (0.56) HSD11B1GNEHSD17B14KDM4EALOX15
SCHEMBL27896675 0.88 HSD17B14 (0.64) HSD11B1GNEHSD17B14CNR1PRKCQ
SCHEMBL12469440 0.85 PRKCA (0.62) HSD11B1GNEHSD17B14KDM4EALOX15
SCHEMBL10002521 0.84 HSD11B1 (0.58) HSD11B1HSD17B14KDM4ETSHRCNR1
SCHEMBL1779262 0.83 KMO (0.55) HSD11B1GNEKDM4EALOX15TSHR
SCHEMBL29483989 0.83 KMO (0.55) HSD11B1GNEKDM4EALOX15TSHR
SCHEMBL2638000 0.83 HTR3A (0.58) HSD11B1GNEHSD17B14KDM4EALOX15
SCHEMBL27415238 0.83 PRKCA (0.59) HSD11B1GNEKDM4EALOX15TSHR

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-2025049326-A1 TRICYCLIC HETEROAROMATIC INHIBITORS OF KLK5 BIOCRYST PHARMACEUTICALS, INC. (US) 2025-03-06 WO disclosed