SCHEMBL7703898

SCHEMBL7703898

N#Cc1cc2c3c(cccc3c1N1CC[C@H](NC(=O)O)C1)C(=O)N(OCc1ccccc1)C2=O

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CTSL P07711 1/20 0.39
CTSB P07858 1/20 0.39
CTSK P43235 1/20 0.39
CHRM4 P08173 2/20 0.35
USP30 Q70CQ3 3/20 0.35
F10 P00742 1/20 0.34
P2RY12 Q9H244 1/20 0.34
RET P07949 1/20 0.34
CD274 Q9NZQ7 1/20 0.34
MTNR1A P48039 2/20 0.33
MTNR1B P49286 2/20 0.33
CREBBP Q92793 2/20 0.33
PPARG P37231 1/20 0.33
DRD2 P14416 1/20 0.33
DRD4 P21917 1/20 0.33
DRD3 P35462 1/20 0.33
SMPD3 Q9NY59 1/20 0.33

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
SCHEMBL7703836 0.88 SIGMAR1 (0.37) CTSLCTSBCTSKMTNR1AMTNR1B
SCHEMBL7709722 0.85 LMNA (0.36) CTSLCTSBCTSKCHRM4USP30
SCHEMBL7706689 0.83 MEN1 (0.39)
SCHEMBL7709619 0.82 MEN1 (0.39)
SCHEMBL7709557 0.74 MEN1 (0.48)
SCHEMBL7703733 0.72 POLB (0.39)
SCHEMBL7703732 0.72 POLB (0.39)
SCHEMBL7703741 0.72 MDM4 (0.39) MTNR1AMTNR1B
SCHEMBL7703947 0.70 MEN1 (0.39)
SCHEMBL7703674 0.69 MEN1 (0.41)

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