SCHEMBL7703710

SCHEMBL7703710

O=C1NC(=O)c2cc(Cl)c(N3CCCC3)c3cc(Br)cc1c23

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 2/20 0.38
LRRK2 Q5S007 1/20 0.33
PPOX P50336 1/20 0.32
CES1 P23141 1/20 0.31
MAT2A P31153 2/20 0.31
IP6K1 Q92551 1/20 0.31
TDP2 O95551 1/20 0.31
LMNA P02545 1/20 0.30
PRNP P04156 1/20 0.30
MAPT P10636 1/20 0.30
ALOX15 P16050 1/20 0.30
TSHR P16473 1/20 0.30
PPARG P37231 1/20 0.30
HTT P42858 1/20 0.30
RXFP1 Q9HBX9 1/20 0.30
NR2E3 Q9Y5X4 1/20 0.30
NCOR2 Q9Y618 1/20 0.30
MAOA P21397 2/20 0.30
MAOB P27338 2/20 0.30

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
SCHEMBL7709502 0.83 POLB (0.40) LMNAMAPTTSHRHTT
SCHEMBL1356289 0.68 NPSR1 (0.56) NPSR1PPOXCES1TDP2MAPT
SCHEMBL7709472 0.63 MEN1 (0.40) NPSR1LMNAMAPTTSHRHTT
SCHEMBL28700474 0.63 NPSR1 (0.49) NPSR1PPOXCES1TDP2MAPT
SCHEMBL17578898 0.61 TERT (0.50) NPSR1MAPTALOX15TSHRHTT
SCHEMBL6796386 0.61 PPOX (0.45) NPSR1PPOXCES1LMNAMAPT
SCHEMBL14463542 0.61 ALDH1A1 (0.60) NPSR1LMNAMAPTALOX15TSHR
SCHEMBL13129894 0.60 PPOX (0.41) NPSR1LRRK2PPOXCES1MAOA
SCHEMBL7709788 0.60 KMT2A (0.47) LMNAMAPTALOX15TSHRHTT
SCHEMBL1413190 0.60 PPOX (0.58) NPSR1PPOXCES1LMNAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0939754-A2 N-OXY-NAPHTHALIMIDES AS ANTIBACTERIAL AGENTS WARNER-LAMBERT COMPANY (US) 1999-09-08 EP claimed
WO-1998019648-A2 N-OXY-NAPHTHALIMIDES AS ANTIBACTERIAL AGENTS WARNER-LAMBERT COMPANY (US) 1998-05-14 WO claimed
US-6362181-B1 BACTERICIDES; ENZYME INHIBITORS; ANTITUMOR AGENTS WARNER-LAMBERT COMPANY 2002-03-26 US disclosed
US-6177423-B1 N-(HYDROXY OR PROTECTED HYDROXY)-BENZO(DE)ISOQUINOLINE-1,3-DIONE DERIVATIVES; BACTERIAL DNA GYRASE AND DNA TOPOISOMERASE INHIBITORS USEFUL FOR ANTIBACTERIAL AGENTS HAVING REDUCED DRUG RESISTANCE AND REDUCED SIDE EFFECTS WARNER-LAMBERT COMPANY 2001-01-23 US disclosed
EP-0939754-A2 N-OXY-NAPHTHALIMIDES AS ANTIBACTERIAL AGENTS WARNER-LAMBERT COMPANY (US) 1999-09-08 EP disclosed
WO-1998019648-A2 N-OXY-NAPHTHALIMIDES AS ANTIBACTERIAL AGENTS WARNER-LAMBERT COMPANY (US) 1998-05-14 WO disclosed