SCHEMBL31432045

SCHEMBL31432045

CC(C)CC(C)NC(=O)c1cccc(C(=O)O)n1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.52
ALOX15 P16050 1/20 0.52
TSHR P16473 1/20 0.52
ACMSD Q8TDX5 1/20 0.52
TDP1 Q9NUW8 1/20 0.52
CNR2 P34972 6/20 0.51
ELANE P08246 1/20 0.45
CTSG P08311 1/20 0.45
CYP3A4 P08684 1/20 0.45
PSMB1 P20618 1/20 0.45
CMA1 P23946 1/20 0.45
PSMB8 P28062 1/20 0.45
PSMB9 P28065 1/20 0.45
PSMB5 P28074 1/20 0.45
PSMB10 P40306 1/20 0.45
PSMB2 P49721 1/20 0.45
MLYCD O95822 1/20 0.44
CNR1 P21554 1/20 0.44
GRN P28799 1/20 0.44
SORT1 Q99523 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
SCHEMBL18157898 0.82 MEN1 (0.56) KDM4EALOX15TSHRACMSDTDP1
SCHEMBL3105049 0.82 KDM4E (0.61) KDM4EALOX15TSHRACMSDTDP1
SCHEMBL12194924 0.78 KDM4E (0.55) KDM4EALOX15TSHRACMSDTDP1
SCHEMBL31432073 0.78 KDM4E (0.55) KDM4EALOX15TSHRACMSDTDP1
SCHEMBL13301518 0.77 KDM4E (0.53) KDM4EALOX15TSHRACMSDTDP1
SCHEMBL13460228 0.77 KDM4E (0.53) KDM4EALOX15TSHRACMSDTDP1
SCHEMBL13753279 0.74 MLYCD (0.64) PSMB5MLYCD
SCHEMBL13753268 0.74 MLYCD (0.64) PSMB5MLYCD
SCHEMBL30380244 0.73 KDM4E (0.68) KDM4EALOX15TSHRACMSDTDP1
SCHEMBL29977651 0.73 KDM4E (0.68) KDM4EALOX15TSHRACMSDTDP1

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