SCHEMBL7715419

SCHEMBL7715419

O=C(O)c1cc(-c2c[nH]c3ccccc23)nc2ccccc12

nearest known ligand 0.81

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.81
MAPT P10636 2/20 0.81
MEN1 O00255 2/20 0.73
KMT2A Q03164 2/20 0.73
SMN1; SMN2 Q16637 3/20 0.60
LMNA P02545 2/20 0.60
PDE10A Q9Y233 2/20 0.60
ALDH1A1 P00352 2/20 0.57
CYP1A2 P05177 1/20 0.57
CYP3A4 P08684 1/20 0.57
CYP2D6 P10635 1/20 0.57
CYP2C9 P11712 1/20 0.57
CYP2C19 P33261 1/20 0.57
NPSR1 Q6W5P4 1/20 0.57
GPR55 Q9Y2T6 1/20 0.57
DHODH Q02127 2/20 0.57
NPC1 O15118 1/20 0.56
RAB9A P51151 1/20 0.56
AKR1C3 P42330 1/20 0.56
AKR1C2 P52895 1/20 0.56

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
SCHEMBL7710271 0.89 MAPT (0.66) KDM4EMAPTMEN1KMT2ASMN1; SMN2
SCHEMBL7710279 0.86 KDM4E (0.62) KDM4EMAPTMEN1KMT2ASMN1; SMN2
SCHEMBL8176662 0.84 KDM4E (0.73) KDM4EMAPTMEN1KMT2ASMN1; SMN2
SCHEMBL7718225 0.80 ELANE (0.60) KDM4EMAPTMEN1KMT2ASMN1; SMN2
SCHEMBL29359819 0.80 KDM4E (0.83) KDM4EMEN1KMT2ASMN1; SMN2LMNA
SCHEMBL18746 0.80 KDM4E (0.83) KDM4EMEN1KMT2ASMN1; SMN2LMNA
SCHEMBL8324531 0.79 MEN1 (0.77) KDM4EMEN1KMT2ASMN1; SMN2LMNA
Potassium SCHEMBL93448 0.78 KDM4E (0.80) KDM4EMEN1KMT2ASMN1; SMN2LMNA
SCHEMBL374556 0.78 KDM4E (0.80) KDM4EMEN1KMT2ASMN1; SMN2LMNA
SCHEMBL30595092 0.78 KDM4E (0.80) KDM4EMEN1KMT2ASMN1; SMN2LMNA

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
US-6376670-B1 BACTERICIDE FOR GRAMPOSITIVE BACTERIA SEPRACOR INC. 2002-04-23 US disclosed
US-6207679-B1 FOR INHIBITING GROWTH OF BACTERIAL MICROORGANISMS SEPRACOR, INC. 2001-03-27 US disclosed
US-6172084-B1 BACTERICIDES AGAINST ANTIBIOTIC RESISTANT STRAINS OF STAPHYLOCOCCUS, STREPTOCOCCUS AND ENTEROCOCCUS SEPRACOR, INC. 2001-01-09 US disclosed
US-6103905-A EFFECTIVE AGAINST DRUG RESISTANT GRAMPOSITIVE BACTERIAL INFECTIONS; ANTIBIOTICS SEPRACOR, INC. (US) 2000-08-15 US disclosed
WO-2000034265-A2 QUINOLINE-INDOLE ANTIMICROBIAL AGENTS SEPRACOR, INC. (US) 2000-06-15 WO disclosed
EP-0991623-A2 QUINOLINE-INDOLE ANTIMICROBIAL AGENTS, USES AND COMPOSITIONS RELATED THERETO SEPRACOR, INC. (US) 2000-04-12 EP disclosed
WO-1998057931-A2 QUINOLINE-INDOLE ANTIMICROBIAL AGENTS, USES AND COMPOSITIONS RELATED THERETO SEPRACOR INC. (US) 1998-12-23 WO disclosed