SCHEMBL7706689

SCHEMBL7706689

N#Cc1cc2c3c(cccc3c1N1CCCC1)C(=O)N(OCc1ccccc1)C2=O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 8/20 0.39
KMT2A Q03164 8/20 0.39
MAPT P10636 4/20 0.39
RAB9A P51151 2/20 0.38
NPC1 O15118 1/20 0.38
AVPR1A P37288 1/20 0.38
ALDH1A1 P00352 3/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
ENPP1 P22413 1/20 0.36
L3MBTL1 Q9Y468 4/20 0.36
USP2 O75604 3/20 0.36
HTT P42858 3/20 0.36
TLR9 Q9NR96 2/20 0.36
TNNI3 P19429 1/20 0.36
TNNT2 P45379 1/20 0.36
TNNC1 P63316 1/20 0.36
PLK1 P53350 2/20 0.36
LMNA P02545 2/20 0.35
CYP1B1 Q16678 2/20 0.35
RGS12 O14924 1/20 0.35

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
SCHEMBL7709619 0.99 MEN1 (0.39) MEN1KMT2AMAPTRAB9ANPC1
SCHEMBL7703674 0.85 MEN1 (0.41) MEN1KMT2AMAPTRAB9ANPC1
SCHEMBL7706731 0.85 CYP1B1 (0.45) MEN1KMT2AMAPTRAB9ANPC1
SCHEMBL7706752 0.84 CYP1B1 (0.44) MEN1KMT2AMAPTRAB9ANPC1
SCHEMBL7709683 0.83 PRMT1 (0.41) MEN1KMT2AMAPTRAB9ANPC1
SCHEMBL7703898 0.83 CTSL (0.39)
SCHEMBL7709557 0.82 MEN1 (0.48) MEN1KMT2AMAPTALDH1A1SMN1; SMN2
SCHEMBL7703835 0.82 ALDH1A1 (0.42) MEN1KMT2AMAPTRAB9ANPC1
SCHEMBL7709679 0.80 HTT (0.50) MEN1KMT2AMAPTRAB9ANPC1
SCHEMBL7703821 0.80 MEN1 (0.58) MEN1KMT2AMAPTRAB9ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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