SCHEMBL7612583

SCHEMBL7612583

CSc1ccc(NC(=O)N(O)C2CCCCC2)cc1

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ ATM Q13315 1/20 0.50
▸ RAB9A P51151 1/20 0.49
▸ KMT2A Q03164 3/20 0.47
▸ ALDH1A1 P00352 5/20 0.46
▸ SMN1; SMN2 Q16637 2/20 0.46
▸ POLB P06746 1/20 0.46
▸ NOX1 Q9Y5S8 1/20 0.46
▸ FPR2 P25090 3/20 0.43
▸ EPHX2 P34913 1/20 0.43
▸ LMNA P02545 2/20 0.42
▸ TNF P01375 1/20 0.41
▸ MAPT P10636 2/20 0.41
▸ RXFP1 Q9HBX9 1/20 0.41
▸ HPGD P15428 1/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ CYP1A2 P05177 1/20 0.40
▸ CYP3A4 P08684 1/20 0.40

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
SCHEMBL7612008 0.84 KMT2A (0.60) ATMRAB9AKMT2ASMN1; SMN2POLB
SCHEMBL7614096 0.80 ATM (0.69) ATMRAB9AKMT2AALDH1A1SMN1; SMN2
SCHEMBL7620949 0.80 ATM (0.69) ATMRAB9AKMT2AALDH1A1SMN1; SMN2
SCHEMBL7617068 0.80 RAB9A (0.58) ATMRAB9AALDH1A1SMN1; SMN2EPHX2
SCHEMBL7613507 0.79 ATM (0.67) ATMRAB9AKMT2AALDH1A1SMN1; SMN2
SCHEMBL7615703 0.77 EPHX1 (0.60) ATMRAB9AKMT2AALDH1A1SMN1; SMN2
SCHEMBL7609575 0.75 NOX1 (0.60) RAB9AKMT2AALDH1A1NOX1FPR2
SCHEMBL2752680 0.72 EPHX1 (0.68) RAB9AKMT2AALDH1A1SMN1; SMN2EPHX2
SCHEMBL7612631 0.71 NOX1 (0.51) RAB9AKMT2AALDH1A1SMN1; SMN2NOX1
SCHEMBL5534712 0.70 RAB9A (0.64) ATMRAB9AKMT2AALDH1A1SMN1; 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 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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