SCHEMBL11815260

SCHEMBL11815260

CCOC(=O)c1cn(CC)c2cc(C3CCCCC3)c(OC)cc2c1=O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.53
▸ HPGD P15428 4/20 0.50
▸ POLB P06746 1/20 0.50
▸ KDM4E B2RXH2 5/20 0.49
▸ ALDH1A1 P00352 4/20 0.49
▸ HSD17B10 Q99714 3/20 0.49
▸ KMT2A Q03164 3/20 0.48
▸ MEN1 O00255 2/20 0.48
▸ MAPT P10636 1/20 0.48
▸ THRB P10828 1/20 0.48
▸ MAPK1 P28482 2/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ PDE4A P27815 1/20 0.45
▸ PDE4B Q07343 1/20 0.45
▸ PDE4C Q08493 1/20 0.45
▸ PDE4D Q08499 1/20 0.45
▸ PDE10A Q9Y233 3/20 0.45
▸ GAA P10253 1/20 0.44
▸ TDP1 Q9NUW8 1/20 0.42
▸ TSHR P16473 1/20 0.42

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
SCHEMBL11815418 0.89 KDM4E (0.55) LMNAHPGDPOLBKDM4EALDH1A1
SCHEMBL11820333 0.85 POLB (0.61) LMNAHPGDPOLBKDM4EALDH1A1
SCHEMBL7057820 0.84 LMNA (0.65) LMNAHPGDPOLBKDM4EALDH1A1
SCHEMBL9442734 0.81 HSD17B10 (0.63) LMNAHPGDPOLBKDM4EALDH1A1
SCHEMBL11820183 0.81 LMNA (0.64) LMNAHPGDPOLBKDM4EALDH1A1
SCHEMBL11820366 0.81 LMNA (0.55) LMNAHPGDPOLBKDM4EALDH1A1
SCHEMBL11813745 0.81 LMNA (0.64) LMNAHPGDPOLBKDM4EALDH1A1
SCHEMBL7282582 0.80 LMNA (0.60) LMNAHPGDPOLBKDM4EALDH1A1
SCHEMBL7298147 0.80 LMNA (0.60) LMNAHPGDPOLBKDM4EALDH1A1
SCHEMBL11818406 0.74 ALDH1A1 (0.51) LMNAPOLBKDM4EALDH1A1KMT2A

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-3960868-A Derivatives of 6,7 or 8 cycloalkyl 4-oxo quinoline 3 carboxylic acid CIBA-GEIGY CORPORATION (US) 1976-06-01 — — US disclosed
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