SCHEMBL9770566

SCHEMBL9770566

Nc1c(N2CCOCC2)c(Nc2ccccc2)nc2ccccc12

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.55
LMNA P02545 5/20 0.55
HPGD P15428 4/20 0.55
ALDH1A1 P00352 3/20 0.55
HTT P42858 3/20 0.55
MAPK1 P28482 4/20 0.55
MAPT P10636 4/20 0.55
SMN1; SMN2 Q16637 2/20 0.55
MEN1 O00255 2/20 0.55
KMT2A Q03164 2/20 0.55
HTR2A P28223 1/20 0.55
KDM1A O60341 1/20 0.54
CTSK P43235 1/20 0.53
HSD17B10 Q99714 2/20 0.51
GLA P06280 1/20 0.51
GAA P10253 1/20 0.51
NCF1 P14598 1/20 0.50
NPSR1 Q6W5P4 1/20 0.49
ALOX15 P16050 1/20 0.48
PIM1 P11309 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
SCHEMBL9770666 0.82 KDM4E (0.49) KDM4ELMNAHPGDALDH1A1HTT
SCHEMBL9770560 0.80 ALDH1A1 (0.54) KDM4ELMNAHPGDALDH1A1HTT
SCHEMBL9770654 0.79 KDM4E (0.56) KDM4ELMNAHPGDALDH1A1HTT
SCHEMBL9770449 0.78 CTSK (0.49) KDM4ELMNAALDH1A1HTTMAPK1
SCHEMBL4701242 0.74 KDM4E (0.69) KDM4ELMNAHPGDALDH1A1HTT
SCHEMBL9770630 0.72 HSD17B10 (0.49) KDM4EHPGDALDH1A1MAPTSMN1; SMN2
SCHEMBL9770657 0.72 KDM4E (0.49) KDM4ELMNAHPGDALDH1A1MAPT
SCHEMBL1825303 0.72 LMNA (0.97) KDM4ELMNAHPGDALDH1A1HTT
SCHEMBL2590824 0.72 HTR2A (0.84) KDM4ELMNAHPGDALDH1A1HTT
SCHEMBL11915878 0.72 KDM4E (0.49) KDM4ELMNAHPGDALDH1A1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5019574-A 3,4-diaminoquinoline and 3,4-diamino-5,6,7,8-tetrahydroquinoline compounds useful for improving psychoneural function CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 1991-05-28 US disclosed
EP-0361489-A2 Novel 3,4-diaminoquinoline and pyridine compounds Chugai Seiyaku Kabushiki Kaisha (JP) 1990-04-04 EP disclosed