SCHEMBL8581502

SCHEMBL8581502

Clc1nncc2c1cc1ccccn12

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 10/20 0.38
ALDH1A1 P00352 9/20 0.38
GAA P10253 4/20 0.38
HSD17B10 Q99714 4/20 0.38
GLA P06280 3/20 0.38
HPGD P15428 3/20 0.38
KMT2A Q03164 6/20 0.37
MEN1 O00255 5/20 0.37
MAPK1 P28482 4/20 0.37
MAPT P10636 7/20 0.35
L3MBTL1 Q9Y468 3/20 0.35
CYP1A2 P05177 1/20 0.35
CYP2D6 P10635 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
RAB9A P51151 6/20 0.35
NPC1 O15118 4/20 0.35
POLB P06746 3/20 0.35
CHEK1 O14757 1/20 0.34
LIMK1 P53667 1/20 0.34

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
SCHEMBL8581523 0.72 ALDH1A1 (0.42) KDM4EALDH1A1GAAHSD17B10GLA
SCHEMBL9752488 0.71 MAPT (0.37) KDM4EALDH1A1GAAHSD17B10HPGD
SCHEMBL17620565 0.70 KDM4E (0.53) KDM4EALDH1A1GAAHSD17B10GLA
SCHEMBL8603348 0.70 KMT2A (0.33) KDM4EALDH1A1KMT2AMEN1MAPK1
SCHEMBL8576911 0.68 HSD17B10 (0.53) KDM4EALDH1A1GAAHSD17B10GLA
SCHEMBL21886150 0.66 KDM4E (0.43) KDM4EALDH1A1GAAHSD17B10GLA
SCHEMBL9600939 0.65 HSD11B1 (0.39) KDM4EALDH1A1MAPT
SCHEMBL19233623 0.63 MAPT (0.33) KDM4EALDH1A1GAAHSD17B10GLA
SCHEMBL370015 0.63 KDM4E (0.37) KDM4EALDH1A1GAAHSD17B10GLA
SCHEMBL9752552 0.62 ALDH1A1 (0.37) KDM4EALDH1A1GAAHSD17B10GLA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5756501-A USEFUL FOR TREATING ALZHIMER'S DISEASE, DOWN'S SYNDROM AND PARKINSON'S DISEASE INVOLVING HYPOFUNCTION OF ACETYLCHOLINE IN MAMMAL AMERICAN HOME PRODUCTS CORPORATION (US) 1998-05-26 US disclosed