SCHEMBL27542739

SCHEMBL27542739

CCc1cccc(C(=O)OCCCN)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP4F2 P78329 1/20 0.54
▸ CYP4A11 Q02928 1/20 0.54
▸ LOXL2 Q9Y4K0 1/20 0.53
▸ SLC7A5 Q01650 1/20 0.49
▸ TDP1 Q9NUW8 1/20 0.49
▸ LMNA P02545 3/20 0.46
▸ ALDH1A1 P00352 1/20 0.46
▸ CYP1A2 P05177 2/20 0.45
▸ CYP2C9 P11712 2/20 0.45
▸ CYP2C19 P33261 2/20 0.45
▸ TSHR P16473 2/20 0.45
▸ ESR1 P03372 1/20 0.45
▸ CYP3A4 P08684 1/20 0.45
▸ PDE4D Q08499 1/20 0.45
▸ SMN1; SMN2 Q16637 2/20 0.45
▸ NPC1 O15118 1/20 0.45
▸ HPGD P15428 1/20 0.45
▸ RAB9A P51151 1/20 0.45
▸ TP53 P04637 1/20 0.45
▸ MAPT P10636 1/20 0.45

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
SCHEMBL10706157 0.88 L3MBTL1 (0.57) CYP4F2CYP4A11TDP1LMNAALDH1A1
SCHEMBL13291593 0.87 CYP4F2 (0.62) CYP4F2CYP4A11LOXL2SLC7A5LMNA
SCHEMBL5709931 0.85 LMNA (0.59) CYP4F2CYP4A11TDP1LMNAALDH1A1
SCHEMBL3033016 0.84 LMNA (0.66) CYP4F2CYP4A11LOXL2SLC7A5TDP1
SCHEMBL10174530 0.83 SLC7A5 (0.63) CYP4F2CYP4A11LOXL2SLC7A5LMNA
SCHEMBL10174728 0.81 CYP4F2 (0.56) CYP4F2CYP4A11LOXL2SLC7A5LMNA
SCHEMBL28743208 0.81 LMNA (0.58) LOXL2TDP1LMNAALDH1A1CYP1A2
SCHEMBL28280189 0.81 CYP4F2 (0.76) CYP4F2CYP4A11LOXL2ALDH1A1CYP1A2
SCHEMBL129801 0.80 CYP4F2 (0.71) CYP4F2CYP4A11LOXL2ALDH1A1TSHR
SCHEMBL20306713 0.80 SMN1; SMN2 (0.63) CYP4F2CYP4A11LOXL2SLC7A5TDP1

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
CN-1277809-C Benzal indone and benzyl indone derivative(s), and its preparing method and use UNIV ZHEJIANG (CN) 2006-10-04 — — CN disclosed
CN-1709860-A Benzal indone and benzyl indone derivative(s), and its preparing method and use UNIV ZHEJIANG (CN) 2005-12-21 — — CN disclosed
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