SCHEMBL2823211

SCHEMBL2823211

Cc1nc2cc(F)c(F)cc2c(OC(=O)OC(C)C2CC2)c1C

nearest known ligand 0.38

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.38
HPGD P15428 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
ALDH1A1 P00352 1/20 0.38
ACACB O00763 3/20 0.32
KDM4E B2RXH2 1/20 0.31

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
SCHEMBL2820529 0.80 ALDH1A1 (0.30) LMNAHPGDSMN1; SMN2ALDH1A1
SCHEMBL2820533 0.79 L3MBTL1 (0.34) LMNAHPGDSMN1; SMN2ALDH1A1KDM4E
SCHEMBL2823212 0.77 SCN9A (0.34) LMNAHPGDSMN1; SMN2KDM4E
SCHEMBL2819557 0.77 HTT (0.35) LMNAHPGDSMN1; SMN2ALDH1A1KDM4E
SCHEMBL2820005 0.75 ALDH1A1 (0.34) LMNAHPGDSMN1; SMN2ALDH1A1KDM4E
SCHEMBL2819564 0.73 PTGS2 (0.37) LMNAHPGDSMN1; SMN2ALDH1A1ACACB
SCHEMBL2821666 0.72 RAB9A (0.36) LMNAHPGDSMN1; SMN2KDM4E
SCHEMBL2823274 0.72 DHODH (0.31) HPGDALDH1A1KDM4E
SCHEMBL2819998 0.71 P2RX7 (0.32) LMNAHPGDSMN1; SMN2ALDH1A1
SCHEMBL2821034 0.71 PTGS2 (0.33) LMNAHPGDSMN1; SMN2ACACBKDM4E

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
EP-1386914-B1 HALOGENATED QUINOLINE DERIVATIVES AND ECTOPARASITE CONTROLLERS MEIJI SEIKA KAISHA (JP) 2010-10-27 EP disclosed
US-7022855-B2 Halogen-substituted quinoline derivatives and ectoparasite control agent MEIJI SEIKA KAISHA, LTD. (JP) 2006-04-04 US disclosed