SCHEMBL9686415

SCHEMBL9686415

CC(C)(C)n1cc(C(=O)O)c(=O)c2cc(F)c(N3C[C@@H]4CC[C@H]3CN4)nc21

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 6/20 0.46
LMNA P02545 3/20 0.45
CYP2C9 P11712 1/20 0.45
ATP6V1B2 P21281 1/20 0.45
TBXA2R P21731 1/20 0.45
EDNRA P25101 1/20 0.45
TARBP2 Q15633 1/20 0.45
CHRM2 P08172 1/20 0.43
DRD1 P21728 1/20 0.43
KMT2A Q03164 1/20 0.41
EPHA2 P29317 1/20 0.40
FLT4 P35916 1/20 0.40
GSK3B P49841 1/20 0.40
RARB P10826 1/20 0.40
TBXAS1 P24557 1/20 0.40
SLC6A3 Q01959 1/20 0.40
KDM4E B2RXH2 3/20 0.40
HSD17B10 Q99714 3/20 0.40
ABCC4 O15439 1/20 0.40
TOP2A P11388 2/20 0.39

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
SCHEMBL9686661 1.00 DPP4 (0.46) DPP4LMNACYP2C9ATP6V1B2TBXA2R
SCHEMBL10073771 0.92 LMNA (0.44) DPP4LMNACYP2C9ATP6V1B2TBXA2R
SCHEMBL31289391 0.92 LMNA (0.44) DPP4LMNACYP2C9ATP6V1B2TBXA2R
SCHEMBL9686534 0.92 LMNA (0.44) DPP4LMNACYP2C9ATP6V1B2TBXA2R
SCHEMBL9129484 0.92 LMNA (0.44) DPP4LMNACYP2C9ATP6V1B2TBXA2R
SCHEMBL9670599 0.87 DPP4 (0.60) DPP4LMNACYP2C9ATP6V1B2TBXA2R
SCHEMBL9837624 0.86 LMNA (0.62) DPP4LMNACYP2C9ATP6V1B2TBXA2R
SCHEMBL9686377 0.83 LMNA (0.52) DPP4LMNACYP2C9ATP6V1B2TBXA2R
SCHEMBL9866014 0.83 DPP4 (0.57) DPP4LMNACYP2C9ATP6V1B2TBXA2R
SCHEMBL5141828 0.82 DPP4 (0.45) DPP4LMNACYP2C9ATP6V1B2TBXA2R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0288519-A4 1-TERTIARY-ALKYL-SUBSTITUTED NAPHTHYRIDINE- AND QUINOLINE-CARBOXYLIC ACID ANTIBACTERIAL AGENTS 1992-04-15 EP disclosed
US-4965273-A Certain 1-tertiary-butyl-naphthyridone carboxylic acid derivatives anti-bacterial agents BRISTOL-MYERS COMPANY (US) 1990-10-23 US disclosed
US-4954507-A 1-tertiary-alkyl-substituted naphthyridine carboxylic acid antibacterial agents BRISTOL-MYERS COMPANY (US) 1990-09-04 US disclosed
EP-0288519-A1 1-TERTIARY-ALKYL-SUBSTITUTED NAPHTHYRIDINE- AND QUINOLINE-CARBOXYLIC ACID ANTIBACTERIAL AGENTS Bristol-Myers Squibb Company (US) 1988-11-02 EP disclosed
WO-1988002627-A1 1-TERTIARY-ALKYL-SUBSTITUTED NAPHTHYRIDINE- AND QUINOLINE-CARBOXYLIC ACID ANTIBACTERIAL AGENTS BRISTOL-MYERS COMPANY (US) 1988-04-21 WO disclosed