SCHEMBL27290232

SCHEMBL27290232

[CH2]C(F)n1cc(C(=O)O)c(=O)c2ccccc21

nearest known ligand 0.54

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.54
KDM4E B2RXH2 1/20 0.50
CHRM1 P11229 5/20 0.47
ALDH1A1 P00352 1/20 0.41

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
SCHEMBL11777786 0.86 LMNA (0.49) LMNAKDM4ECHRM1
SCHEMBL395598 0.83 LMNA (0.55) LMNAKDM4ECHRM1
SCHEMBL6533794 0.80 LMNA (0.49) LMNAKDM4ECHRM1ALDH1A1
SCHEMBL7545236 0.78 LMNA (0.59) LMNAKDM4ECHRM1ALDH1A1
SCHEMBL30747701 0.78 LMNA (0.59) LMNAKDM4ECHRM1ALDH1A1
SCHEMBL6313804 0.77 LMNA (0.62) LMNAKDM4ECHRM1ALDH1A1
Hydrochloric Acid SCHEMBL27329066 0.76 LMNA (0.57) LMNAKDM4ECHRM1ALDH1A1
SCHEMBL18607753 0.75 LMNA (0.47) LMNAKDM4ECHRM1
SCHEMBL398161 0.74 POLB (0.61) LMNAKDM4EALDH1A1
SCHEMBL30421484 0.74 POLB (0.61) LMNAKDM4EALDH1A1

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
CN-1031710-C Process for preparing quinoline carboxylic acid boric acid anhydride CHINOIN GYOGYSZER ES VEGYESZET (HU) 1996-05-01 CN disclosed
CN-1013114-B Amino and the 5-hydroxyl-6 of 5-, 8-two fluoroquinolone antibacterial agent preparation method of composition WARNER LAMBERT CO (US) 1991-07-10 CN disclosed
CN-88101941-A Process for preparing quinoline carboxylic acid boric anhydride 1988-10-26 CN disclosed
CN-86108942-A Amino and the 5-hydroxyl-6 as the 5-of antimicrobial drug, 8-two fluoroquinolones 1987-11-04 CN disclosed