SCHEMBL8870944

SCHEMBL8870944

CC1(C)CC(=O)c2c(nc3ccccc3c2N)C1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 1.00
KDM4E B2RXH2 8/20 1.00
HPGD P15428 4/20 1.00
HSD17B10 Q99714 3/20 1.00
GLA P06280 2/20 1.00
GAA P10253 1/20 1.00
HTT P42858 1/20 0.50
SMN1; SMN2 Q16637 3/20 0.49
NPSR1 Q6W5P4 2/20 0.49
MEN1 O00255 1/20 0.49
LMNA P02545 1/20 0.49
MAPT P10636 1/20 0.49
MAPK1 P28482 1/20 0.49
KMT2A Q03164 1/20 0.49
ACHE P22303 4/20 0.44
BCHE P06276 3/20 0.44
CYP11B2 P19099 1/20 0.44
CHRM2 P08172 2/20 0.43
ADRA2A P08913 2/20 0.43
ADORA3 P0DMS8 2/20 0.43

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
SCHEMBL10351995 0.82 ALDH1A1 (0.70) ALDH1A1KDM4EHPGDHSD17B10GLA
SCHEMBL10351216 0.82 ALDH1A1 (0.70) ALDH1A1KDM4EHPGDHSD17B10GLA
SCHEMBL10350723 0.82 ALDH1A1 (0.70) ALDH1A1KDM4EHPGDHSD17B10GLA
SCHEMBL10351232 0.81 KDM4E (0.68) ALDH1A1KDM4EHPGDHSD17B10GLA
SCHEMBL10350717 0.80 ALDH1A1 (0.66) ALDH1A1KDM4EHPGDHSD17B10GLA
SCHEMBL10350724 0.80 ALDH1A1 (0.66) ALDH1A1KDM4EHPGDHSD17B10GLA
SCHEMBL10351811 0.79 ALDH1A1 (0.65) ALDH1A1KDM4EHPGDHSD17B10GLA
SCHEMBL10352028 0.79 ALDH1A1 (0.64) ALDH1A1KDM4EHPGDHSD17B10GLA
SCHEMBL10350749 0.78 ALDH1A1 (0.64) ALDH1A1KDM4EHPGDHSD17B10GLA
SCHEMBL9875563 0.77 KDM4E (0.68) ALDH1A1KDM4EHPGDHSD17B10GLA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2167267-A None JP disclosed
US-5672707-A USEFUL FOR TREATING SENILE DEMENTIA OF ALZHEIMER'S DISEASE VSEROSSIISKY NAUCHNY TSENTR PO BEZOPASNOSTI BIOLOGICHESKI AKTIVNYKH VESCHESTV (VNTSBAV) (RU) 1997-09-30 US disclosed
EP-0633251-A1 DERIVATIVES OF 9-AMINOACRIDINE HAVING PSYCHOTROPIC, ANTIAMNESTIC AND LIPID REGULATING PROPERTIES VSESOJUZNY NAUCHNY TSENTR PO BEZOPASNOTI BIOLOGICHESKI ACTIVNYKH VESHCHESTV (RU) 1995-01-11 EP disclosed
JP-H02167267-A ACRIDINE DERIVATIVE FUJISAWA PHARMACEUT CO LTD 1990-06-27 JP disclosed
EP-0371388-A2 Acridine derivatives FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1990-06-06 EP disclosed