SCHEMBL9706255

SCHEMBL9706255

Cc1cc2nc3c4cc(Br)ccc4n(C(C)N4CCOCC4)c3nc2cc1C

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 3/20 0.48
ALOX15 P16050 2/20 0.48
MAPT P10636 6/20 0.39
TSHR P16473 4/20 0.39
LMNA P02545 1/20 0.39
CREBBP Q92793 1/20 0.39
ATM Q13315 2/20 0.35
RXFP1 Q9HBX9 1/20 0.35
HPGD P15428 2/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
DHFR P00374 1/20 0.34
ALDH1A1 P00352 3/20 0.34
POLB P06746 3/20 0.34
KDM4E B2RXH2 1/20 0.34
CASP1 P29466 2/20 0.34
CASP7 P55210 2/20 0.34
TDP1 Q9NUW8 1/20 0.34
AAK1 Q2M2I8 1/20 0.34
AHR P35869 2/20 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
SCHEMBL9706081 0.77 MAPT (0.38) MAPK1ALOX15MAPTTSHRLMNA
SCHEMBL9706257 0.77 ALOX15 (0.80) MAPK1ALOX15MAPTTSHRLMNA
SCHEMBL9706113 0.76 MAPK1 (0.37) MAPK1ALOX15MAPTTSHRLMNA
SCHEMBL9706123 0.68 MAPT (0.47) MAPK1ALOX15MAPTTSHRLMNA
SCHEMBL9706152 0.68 MEN1 (0.45) MAPK1ALOX15MAPTTSHRLMNA
SCHEMBL9706117 0.67 MAPK1 (0.47) MAPK1ALOX15MAPTTSHRLMNA
SCHEMBL9706132 0.66 MAPT (0.51) MAPK1ALOX15MAPTTSHRATM
Dimethylamine SCHEMBL9706094 0.66 MAPT (0.51) MAPK1ALOX15MAPTTSHRLMNA
SCHEMBL9436917 0.65 KDM4E (0.54) MAPK1ALOX15MAPTTSHRLMNA
SCHEMBL9706088 0.65 MAPK1 (0.50) MAPK1ALOX15MAPTTSHRLMNA

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
EP-0238459-B1 SUBSTITUTED INDOLOQUINOXALINES Lundblad, Leif (SE) 1992-04-15 EP disclosed
US-4990510-A Viricides, anticancer agents LEIF LUNDBLAD (BE) 1991-02-05 US disclosed
EP-0238459-A1 Substituted indoloquinoxalines Lundblad, Leif (SE) 1987-09-23 EP disclosed
WO-1987004436-A1 SUBSTITUTED INDOLOQUINOXALINES LUNDBLAD, LEIF (SE) 1987-07-30 WO disclosed