SCHEMBL7613507

SCHEMBL7613507

O=C(Nc1ccccc1)N(O)C1CCCC1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ATM Q13315 1/20 0.67
▸ ALDH1A1 P00352 2/20 0.53
▸ HPGD P15428 1/20 0.53
▸ POLB P06746 2/20 0.51
▸ TP53 P04637 2/20 0.51
▸ MAPT P10636 4/20 0.51
▸ RAB9A P51151 5/20 0.50
▸ SMN1; SMN2 Q16637 3/20 0.50
▸ EPHX2 P34913 2/20 0.50
▸ EPHX1 P07099 2/20 0.50
▸ NPC1 O15118 2/20 0.48
▸ MEN1 O00255 1/20 0.46
▸ LMNA P02545 1/20 0.46
▸ HTR1E P28566 1/20 0.46
▸ KMT2A Q03164 1/20 0.46
▸ S1PR3 Q99500 1/20 0.46
▸ KDM4E B2RXH2 1/20 0.46
▸ KCNH2 Q12809 1/20 0.46
▸ HRH3 Q9Y5N1 1/20 0.46
▸ GAA P10253 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
SCHEMBL7614096 0.98 ATM (0.69) ATMALDH1A1HPGDPOLBTP53
SCHEMBL7620949 0.98 ATM (0.69) ATMALDH1A1HPGDPOLBTP53
SCHEMBL10595718 0.83 ATM (0.71) ATMALDH1A1HPGDPOLBTP53
SCHEMBL11599130 0.80 ATM (1.00) ATMALDH1A1HPGDPOLBTP53
SCHEMBL28798411 0.80 ATM (0.68) ATMALDH1A1HPGDPOLBTP53
SCHEMBL9547525 0.79 ATM (0.66) ATMALDH1A1HPGDPOLBTP53
SCHEMBL7615703 0.79 EPHX1 (0.60) ATMALDH1A1POLBMAPTRAB9A
SCHEMBL7612583 0.79 ATM (0.50) ATMALDH1A1HPGDPOLBMAPT
SCHEMBL7617068 0.79 RAB9A (0.58) ATMALDH1A1HPGDMAPTRAB9A
SCHEMBL5750798 0.78 ATM (0.64) ATMALDH1A1HPGDPOLBTP53

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0777471-B1 INHIBITION OF LEUKOTRIENE BIOSYNTHESIS WITH UREA DERIVATIVES MINNESOTA MINING & MFG (US) 2002-11-27 — — EP claimed
EP-0777471-A1 INHIBITION OF LEUKOTRIENE BIOSYNTHESIS WITH UREA DERIVATIVES MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1997-06-11 — — EP claimed
WO-1996003983-A1 INHIBITION OF LEUKOTRIENE BIOSYNTHESIS WITH UREA DERIVATIVES MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1996-02-15 — — WO claimed
EP-0777471-B1 INHIBITION OF LEUKOTRIENE BIOSYNTHESIS WITH UREA DERIVATIVES MINNESOTA MINING & MFG (US) 2002-11-27 — — EP disclosed
EP-0777471-A1 INHIBITION OF LEUKOTRIENE BIOSYNTHESIS WITH UREA DERIVATIVES MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1997-06-11 — — EP disclosed
US-5612377-A OXYUREA DERIVATIVE MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1997-03-18 — — US disclosed
WO-1996003983-A1 INHIBITION OF LEUKOTRIENE BIOSYNTHESIS WITH UREA DERIVATIVES MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1996-02-15 — — WO disclosed
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