SCHEMBL13010955

SCHEMBL13010955

COC(=O)c1cccc(CN(CO)c2ccccc2C(C)=O)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NR3C1 P04150 2/20 0.53
▸ CYP4F2 P78329 2/20 0.51
▸ CYP4A11 Q02928 2/20 0.51
▸ LOXL2 Q9Y4K0 1/20 0.49
▸ SLC7A5 Q01650 1/20 0.46
▸ CETP P11597 1/20 0.45
▸ RAB9A P51151 4/20 0.43
▸ ALDH1A1 P00352 3/20 0.43
▸ SMN1; SMN2 Q16637 3/20 0.43
▸ KDM4E B2RXH2 2/20 0.43
▸ MAPT P10636 2/20 0.43
▸ HIF1A Q16665 1/20 0.42
▸ MEP1B Q16820 1/20 0.42
▸ HPGD P15428 2/20 0.42
▸ TSHR P16473 1/20 0.42
▸ NPSR1 Q6W5P4 1/20 0.42
▸ LMNA P02545 2/20 0.42
▸ MEN1 O00255 1/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ MRGPRX4 Q96LA9 2/20 0.41

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
SCHEMBL16706893 0.74 LOXL2 (0.62) NR3C1CYP4F2CYP4A11LOXL2SLC7A5
SCHEMBL165622 0.73 LOXL2 (0.66) NR3C1CYP4F2CYP4A11LOXL2SLC7A5
SCHEMBL6960295 0.73 RAB9A (0.58) CYP4F2CYP4A11LOXL2RAB9AALDH1A1
SCHEMBL12826775 0.72 LOXL2 (0.50) NR3C1CYP4F2CYP4A11LOXL2SLC7A5
SCHEMBL10106423 0.72 LOXL2 (0.64) NR3C1CYP4F2CYP4A11LOXL2SLC7A5
SCHEMBL1612858 0.72 KMT2A (0.53) NR3C1RAB9AALDH1A1KDM4EMAPT
SCHEMBL4490305 0.72 LOXL2 (0.52) NR3C1CYP4F2CYP4A11LOXL2SLC7A5
SCHEMBL21377435 0.71 PTPN1 (0.64) NR3C1CYP4F2CYP4A11LOXL2SLC7A5
SCHEMBL31276630 0.71 CYP4F2 (0.75) CYP4F2CYP4A11LOXL2SLC7A5RAB9A
SCHEMBL40012 0.71 CYP4F2 (0.75) CYP4F2CYP4A11LOXL2SLC7A5RAB9A

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
EP-2261206-A1 INDOLINONE COMPOUND Astellas Pharma Inc. (JP) 2010-12-15 — — EP disclosed
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