SCHEMBL2820529

SCHEMBL2820529

Cc1nc2ccc(F)c(F)c2c(OC(=O)OC(C)C2CC2)c1C

nearest known ligand 0.31

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.30
LMNA P02545 1/20 0.30
HPGD P15428 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
OPRK1 P41145 1/20 0.30

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
SCHEMBL5833104 0.87 GPR119 (0.31)
SCHEMBL2820048 0.83 MMP13 (0.37) ALDH1A1SMN1; SMN2
SCHEMBL2823045 0.80 KMT2A (0.33) ALDH1A1HPGDSMN1; SMN2
SCHEMBL2823211 0.80 LMNA (0.38) ALDH1A1LMNAHPGDSMN1; SMN2
SCHEMBL2820325 0.79 TSHR (0.40) ALDH1A1LMNAHPGD
SCHEMBL2820531 0.78 OPRL1 (0.37)
SCHEMBL2820985 0.78 MMP13 (0.34) ALDH1A1LMNAHPGD
SCHEMBL2821657 0.77 KDM4E (0.38) ALDH1A1LMNAHPGDSMN1; SMN2
SCHEMBL2820199 0.77 MMP13 (0.31)
SCHEMBL2819552 0.76 KDM4E (0.32) ALDH1A1

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