SCHEMBL24344012

SCHEMBL24344012

CC(C)CC(NC(=O)c1ccccc1N)C(=O)Oc1c(F)c(F)c(F)c(F)c1F

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.47
KDM4E B2RXH2 1/20 0.47
TDP1 Q9NUW8 1/20 0.43
TAS1R3 Q7RTX0 5/20 0.43
TAS1R1 Q7RTX1 5/20 0.43
CLPP Q16740 2/20 0.42
GAA P10253 1/20 0.42
HSD17B10 Q99714 1/20 0.42
CNR1 P21554 2/20 0.41
CNR2 P34972 2/20 0.41
CTSK P43235 2/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
KCNA5 P22460 1/20 0.40
ATM Q13315 1/20 0.40

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
SCHEMBL23638202 1.00 ALDH1A1 (0.47) ALDH1A1KDM4ETDP1TAS1R3TAS1R1
SCHEMBL23638369 0.84 ALDH1A1 (0.52) ALDH1A1KDM4EHSD17B10CTSKSMN1; SMN2
SCHEMBL23638344 0.81 NPSR1 (0.52) ALDH1A1KDM4ETDP1GAAATM
SCHEMBL23875447 0.81 NPSR1 (0.52) ALDH1A1KDM4ETDP1GAAATM
SCHEMBL23638201 0.80 F2R (0.40) TDP1TAS1R3TAS1R1CLPPGAA
SCHEMBL24344552 0.80 F2R (0.40) TDP1TAS1R3TAS1R1CLPPGAA
SCHEMBL2669218 0.79 KDM4E (0.60) ALDH1A1KDM4ECLPP
SCHEMBL23638345 0.79 KDM4E (0.60) ALDH1A1KDM4ECLPP
SCHEMBL25840835 0.76 GAA (0.37) TDP1TAS1R3TAS1R1CLPPGAA
SCHEMBL6183877 0.75 CTSL (0.71) ALDH1A1KDM4ECTSK

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230220589-A1 POLYPEPTIDE TERMINAL BINDERS AND USES THEREOF Encodia, Inc. (US) 2023-07-13 US disclosed
WO-2022072560-A1 POLYPEPTIDE TERMINAL BINDERS AND USES THEREOF Encodia, Inc. (US) 2022-04-07 WO disclosed