SCHEMBL8488373

SCHEMBL8488373

CCOC(=O)N1CCN(c2cc3c(cc2F)C(=O)CCN3CC)CC1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GPR174 Q9BXC1 3/20 0.58
▸ MAPT P10636 11/20 0.56
▸ ALDH1A1 P00352 6/20 0.56
▸ HTT P42858 2/20 0.56
▸ SMN1; SMN2 Q16637 2/20 0.55
▸ HPGD P15428 2/20 0.54
▸ ALOX15 P16050 2/20 0.54
▸ TSHR P16473 2/20 0.54
▸ HSD17B10 Q99714 2/20 0.54
▸ KDM4E B2RXH2 2/20 0.54
▸ GAA P10253 2/20 0.54
▸ POLB P06746 1/20 0.54
▸ MEN1 O00255 3/20 0.53
▸ KMT2A Q03164 3/20 0.53
▸ CYP1A2 P05177 1/20 0.53
▸ CYP2C9 P11712 1/20 0.53
▸ CYP2C19 P33261 1/20 0.53
▸ L3MBTL1 Q9Y468 1/20 0.53
▸ LMNA P02545 2/20 0.53
▸ MAPK1 P28482 2/20 0.53

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
SCHEMBL28668402 0.82 MAPT (0.48) MAPTALDH1A1SMN1; SMN2HPGDKDM4E
SCHEMBL29724092 0.82 MAPT (0.48) MAPTALDH1A1SMN1; SMN2HPGDKDM4E
SCHEMBL29724110 0.79 ALDH1A1 (0.47) GPR174MAPTALDH1A1HTTSMN1; SMN2
SCHEMBL8487393 0.76 NOTUM (0.34) MAPTALDH1A1HPGDTSHRLMNA
SCHEMBL28697213 0.74 MAPT (0.49) GPR174MAPTALDH1A1SMN1; SMN2HPGD
SCHEMBL22621295 0.73 GPR174 (1.00) GPR174MAPTALDH1A1HTTSMN1; SMN2
SCHEMBL28933806 0.70 L3MBTL1 (0.71) GPR174MAPTALDH1A1HTTSMN1; SMN2
SCHEMBL11072823 0.70 TSHR (0.55) MAPTALDH1A1HTTSMN1; SMN2TSHR
SCHEMBL28017211 0.70 BAZ2B (0.46) MAPTALDH1A1SMN1; SMN2HPGDHSD17B10
SCHEMBL22621305 0.69 GPR174 (1.00) GPR174MAPTALDH1A1HTTSMN1; SMN2

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-5914401-A Methods for the manufacture of quinolone carboxylic acids derivatives and intermediates thereof APOTEX, INC. (CA) 1999-06-22 — — US disclosed
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