SCHEMBL14472239

SCHEMBL14472239

CC(C)c1nc2c(cc1F)c(=O)c(C(=O)O)cn2C1CC1

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ DPP4 P27487 6/20 0.56
▸ TOP2A P11388 8/20 0.53
▸ TOP2B Q02880 8/20 0.53
▸ CHRM2 P08172 1/20 0.51
▸ DRD1 P21728 1/20 0.51
▸ KDM4E B2RXH2 4/20 0.48
▸ ALDH1A1 P00352 3/20 0.48
▸ LMNA P02545 3/20 0.48
▸ HSD17B10 Q99714 3/20 0.48
▸ ABCC4 O15439 1/20 0.48
▸ KCNH2 Q12809 2/20 0.48
▸ HPGD P15428 2/20 0.48
▸ MAPT P10636 1/20 0.48
▸ CYP1A2 P05177 1/20 0.47
▸ CYP2C9 P11712 1/20 0.47

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
SCHEMBL16213450 0.86 DPP4 (0.52) DPP4TOP2ATOP2BCHRM2DRD1
SCHEMBL10330767 0.85 TOP2A (0.59) DPP4TOP2ATOP2BCHRM2DRD1
SCHEMBL5142702 0.84 DPP4 (0.58) DPP4TOP2ATOP2BCHRM2DRD1
SCHEMBL9437304 0.84 TOP2A (0.58) DPP4TOP2ATOP2BCHRM2DRD1
SCHEMBL10876232 0.82 DPP4 (0.59) DPP4TOP2ATOP2BCHRM2DRD1
SCHEMBL500472 0.82 DPP4 (0.57) DPP4TOP2ATOP2BCHRM2DRD1
SCHEMBL12665410 0.82 LMNA (0.43) DPP4TOP2ATOP2BKDM4EALDH1A1
SCHEMBL14143514 0.82 DPP4 (0.54) DPP4TOP2ATOP2BCHRM2DRD1
SCHEMBL13014061 0.82 DPP4 (0.54) DPP4TOP2ATOP2BCHRM2DRD1
SCHEMBL9669861 0.81 DPP4 (0.68) DPP4TOP2ATOP2BCHRM2DRD1

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
US-7250413-B2 C-25 carbamate rifamycin derivatives with activity against drug-resistant microbes CUMBRE PHARMACEUTICALS INC. (US) 2007-07-31 — — US disclosed
Send feedback