SCHEMBL7591271

SCHEMBL7591271

O=C(O)c1c2ccccc2nc2cc(Cl)ccc12

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 4/20 0.60
KMT2A Q03164 3/20 0.50
PDE10A Q9Y233 3/20 0.50
FABP3 P05413 3/20 0.50
FABP4 P15090 3/20 0.50
ALDH1A1 P00352 2/20 0.50
KDM4E B2RXH2 1/20 0.50
MEN1 O00255 1/20 0.50
CYP1A2 P05177 1/20 0.50
GLA P06280 1/20 0.50
HPGD P15428 1/20 0.50
CYP2C19 P33261 1/20 0.50
HSD17B10 Q99714 1/20 0.50
DYRK1A Q13627 1/20 0.48
ESR1 P03372 1/20 0.48
ESR2 Q92731 1/20 0.48
LMNA P02545 1/20 0.47
FABP5 Q01469 2/20 0.47
GAA P10253 1/20 0.47
CYP2C9 P11712 1/20 0.47

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
SCHEMBL7699106 0.90 DHODH (0.58) DHODHKMT2APDE10AFABP3FABP4
SCHEMBL29377848 0.84 PDE10A (0.66) DHODHKMT2APDE10AALDH1A1KDM4E
SCHEMBL641899 0.84 PDE10A (0.66) DHODHKMT2APDE10AALDH1A1KDM4E
SCHEMBL11778609 0.83 PLA2G2A (0.56) DHODHKMT2AALDH1A1KDM4EMEN1
Iodide SCHEMBL8029606 0.82 PDE10A (0.63) DHODHKMT2APDE10AALDH1A1KDM4E
Hydrochloric Acid SCHEMBL9597551 0.82 PDE10A (0.63) DHODHKMT2APDE10AALDH1A1KDM4E
Water SCHEMBL2991911 0.82 PDE10A (0.63) DHODHKMT2APDE10AALDH1A1KDM4E
Hydrochloric Acid SCHEMBL1603404 0.82 PDE10A (0.63) DHODHKMT2APDE10AALDH1A1KDM4E
Iodide SCHEMBL8029601 0.82 PDE10A (0.63) DHODHKMT2APDE10AALDH1A1KDM4E
SCHEMBL3902074 0.81 DHODH (0.55) DHODHKMT2APDE10AALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0778946-B1 NOVEL METHOD AND KITS FOR PRODUCING LIGHT FROM AN ACRIDAN COMPOUND LUMIGEN INC (US) 2002-10-23 EP disclosed
EP-0778946-A4 NOVEL METHOD AND KITS FOR PRODUCING LIGHT FROM AN ACRIDAN COMPOUND LUMIGEN INC (US) 1999-01-27 EP disclosed
US-5723295-A MULTISTAGE CHEMILUMINESCENT ASSAY WITH PEROXIDASE ENZYME, PH ADJUSTMENT LUMIGEN, INC. (US) 1998-03-03 US disclosed
CN-1161083-A Novel method and kits for producing light from 9,10-azetine compound LUMIGEN INC (US) 1997-10-01 CN disclosed
US-5670644-A CHEMILUMINESCENT REACTIONS, PEROXIDASE AND PH FOR IMMUNOASSAY LUMIGEN, INC. (US) 1997-09-23 US disclosed
EP-0778946-A1 NOVEL METHOD AND KITS FOR PRODUCING LIGHT FROM AN ACRIDAN COMPOUND LUMIGEN, INC. (US) 1997-06-18 EP disclosed
WO-1996007912-A1 NOVEL METHOD AND KITS FOR PRODUCING LIGHT FROM AN ACRIDAN COMPOUND LUMIGEN, INC. (US) 1996-03-14 WO disclosed
US-3979515-A THYMOANALEPTIC ACTIVITY ROUSSEL-UCLAF (FR) 1976-09-07 US disclosed
US-3957757-A THYMOANALEPTICS ROUSSEL-UCLAF (FR) 1976-05-18 US disclosed