SCHEMBL7797045

SCHEMBL7797045

O=C(Oc1ccc(F)cc1)c1c2ccccc2nc2ccccc12

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.48
KMT2A Q03164 4/20 0.47
ATM Q13315 1/20 0.47
KDM4E B2RXH2 4/20 0.46
MEN1 O00255 3/20 0.46
HTT P42858 2/20 0.46
CYP1A2 P05177 1/20 0.46
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
ALDH1A1 P00352 2/20 0.44
PKM P14618 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
GRM2 Q14416 1/20 0.43
SCN9A Q15858 1/20 0.43
DHODH Q02127 2/20 0.42
PPARG P37231 1/20 0.42
NCOA2 Q15596 1/20 0.42
NCOA1 Q15788 1/20 0.42
NCOA3 Q9Y6Q9 1/20 0.42

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
SCHEMBL5705535 0.89 MAPT (0.50) MAPTKMT2AKDM4EMEN1TDP1
SCHEMBL8741772 0.88 TP53 (0.47) MAPTKMT2AATMKDM4EMEN1
SCHEMBL7043070 0.86 MAPT (0.48) MAPTKMT2AKDM4EMEN1HTT
SCHEMBL8151119 0.84 MAPT (0.55) MAPTKMT2AATMKDM4EMEN1
SCHEMBL7045154 0.84 MAPT (0.56) MAPTKMT2AKDM4EMEN1HTT
SCHEMBL8149705 0.84 MAPT (0.56) MAPTKMT2AATMKDM4EMEN1
SCHEMBL27475817 0.84 KMT2A (0.51) MAPTKMT2AKDM4EMEN1CYP1A2
SCHEMBL8150632 0.82 POLB (0.51) MAPTKMT2AKDM4EMEN1HTT
SCHEMBL4421304 0.81 KMT2A (0.50) MAPTKMT2AKDM4EMEN1HTT
SCHEMBL7030411 0.81 SCN9A (0.43) MAPTKMT2AKDM4EMEN1HTT

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-0750748-B1 NOVEL ARYL N-ALKYLACRIDANCARBOXYLATE DERIVATIVES USEFUL FOR CHEMILUMINESCENT DETECTION LUMIGEN INC (US) 2001-12-05 EP disclosed
US-5750698-A USEFUL IN DETECTING BOTH PEROXIDASE AND PEROXIDE LUMIGEN, INC. (US) 1998-05-12 US disclosed
EP-0750748-A4 NOVEL ARYL N-ALKYLACRIDANCARBOXYLATE DERIVATIVES USEFUL FOR CHEMILUMINESCENT DETECTION LUMIGEN INC (US) 1997-04-16 EP disclosed
US-5593845-A BY REACTION WITH PEROXIDES AND PEROXIDASE; DETECTION OF HAPTENS, PROTEINS, ANTIBODIES IN ENZYME IMMUNOASSAY LUMIGEN, INC. (US) 1997-01-14 US disclosed
EP-0750748-A1 NOVEL ARYL N-ALKYLACRIDANCARBOXYLATE DERIVATIVES USEFUL FOR CHEMILUMINESCENT DETECTION LUMIGEN, INC. (US) 1997-01-02 EP disclosed
WO-1995023971-A1 NOVEL ARYL N-ALKYLACRIDANCARBOXYLATE DERIVATIVES USEFUL FOR CHEMILUMINESCENT DETECTION LUMIGEN, INC. (US) 1995-09-08 WO disclosed