SCHEMBL6204716

SCHEMBL6204716

C[C@@H](c1ccccc1)N1CC(C2(NC(=O)OC(C)(C)C)CC2)C(F)C1=O

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.41
METAP2 P50579 2/20 0.35
DPP8 Q6V1X1 1/20 0.35
DPP9 Q86TI2 1/20 0.35
MAPK1 P28482 2/20 0.35
CTSK P43235 3/20 0.34
HSD11B1 P28845 2/20 0.34
UTS2R Q9UKP6 1/20 0.33
ATM Q13315 1/20 0.33
CTSS P25774 1/20 0.33

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
SCHEMBL6204711 1.00 KMT2A (0.41) KMT2AMETAP2DPP8DPP9MAPK1
SCHEMBL6204713 1.00 KMT2A (0.41) KMT2AMETAP2DPP8DPP9MAPK1
SCHEMBL5783900 0.96 KMT2A (0.39) KMT2AMETAP2DPP8DPP9MAPK1
SCHEMBL5783898 0.96 KMT2A (0.39) KMT2AMETAP2DPP8DPP9MAPK1
SCHEMBL6204721 0.82 UTS2R (0.36) KMT2ADPP8DPP9CTSKUTS2R
SCHEMBL6204726 0.82 UTS2R (0.36) KMT2ADPP8DPP9CTSKUTS2R
SCHEMBL6204723 0.82 UTS2R (0.36) KMT2ADPP8DPP9CTSKUTS2R
SCHEMBL2082301 0.81 KMT2A (0.51) KMT2AMETAP2DPP8DPP9MAPK1
SCHEMBL2082300 0.81 KMT2A (0.51) KMT2AMETAP2DPP8DPP9MAPK1
SCHEMBL5781254 0.78 UTS2R (0.35) KMT2ACTSKUTS2R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1020459-B1 CIS-DISUBSTITUTED AMINOCYCLOALKYL-PYRROLIDINE DERIVATIVES DAIICHI SEIYAKU CO (JP) 2005-04-06 EP disclosed
US-6184388-B1 ANTIBACTERIAL AND ANTIMICROBIAL, QUINOLINE ANTIBIOTIC DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2001-02-06 US disclosed
US-6121285-A 5-AMINO-7-(4-(1-AMINOCYCLOPROPYL-3-FLUORO-1-PYRROLIDINYL)-6 -FLUORO-1-(2-FLUORO-1-CYCLOPROPYL)-1,4-DIHYDRO-8-METHOXY-4-OXOQUINOLINE-3 -CARBOXYLIC ACID, FOR EXAMPLE; ANTIMICROBIAL DRUGS WITH HIGH SAFETY DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2000-09-19 US disclosed
EP-1020459-A1 CIS-DISUBSTITUTED AMINOCYCLOALKYL-PYRROLIDINE DERIVATIVES DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2000-07-19 EP disclosed