SCHEMBL8534976

SCHEMBL8534976

CNCC(O)Cn1c(C)cc2ccccc21

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRMT5 O14744 1/20 0.55
TP53 P04637 4/20 0.52
ALDH1A1 P00352 3/20 0.49
MAPK1 P28482 1/20 0.49
MEN1 O00255 3/20 0.48
KMT2A Q03164 3/20 0.48
HTT P42858 1/20 0.48
KDM4E B2RXH2 3/20 0.48
HDAC1 Q13547 1/20 0.47
HDAC2 Q92769 1/20 0.47
HDAC8 Q9BY41 1/20 0.47
HDAC6 Q9UBN7 1/20 0.47
HDAC9 Q9UKV0 1/20 0.47
CARM1 Q86X55 2/20 0.47
TSHR P16473 3/20 0.46
SMN1; SMN2 Q16637 2/20 0.45
MAPT P10636 2/20 0.45
NPC1 O15118 1/20 0.45
CYP1A2 P05177 1/20 0.45
HSP90AA1 P07900 1/20 0.45

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
SCHEMBL11520647 0.83 PRMT5 (0.59) PRMT5TP53ALDH1A1MEN1KMT2A
SCHEMBL11693545 0.81 PRMT5 (0.56) PRMT5TP53ALDH1A1MEN1KMT2A
SCHEMBL16603956 0.81 BACE1 (0.67) PRMT5ALDH1A1MEN1KMT2AHTT
SCHEMBL17826349 0.80 HPGD (0.63) PRMT5TP53ALDH1A1MAPK1MEN1
SCHEMBL11506155 0.80 PRMT5 (0.54) PRMT5TP53ALDH1A1MEN1KMT2A
SCHEMBL11518221 0.77 ALDH1A1 (0.52) PRMT5TP53ALDH1A1MEN1KMT2A
SCHEMBL11518431 0.76 LMNA (0.62) PRMT5MEN1KMT2AHTTKDM4E
SCHEMBL10412483 0.76 MEN1 (0.52) PRMT5TP53ALDH1A1MEN1KMT2A
SCHEMBL8877177 0.75 PRMT5 (0.50) PRMT5TP53ALDH1A1MEN1KMT2A
SCHEMBL20853336 0.74 PRMT5 (0.49) PRMT5TP53ALDH1A1MEN1KMT2A

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
US-5817651-A ANALGESICS, RHEUMATIC DISEASES, ANTIINFLAMMATORY AGENTS SANOFI (FR) 1998-10-06 US disclosed
US-5607933-A METHODS FOR TREATMENT OF GLAUCOMA AND FOR RELIEF OF PAIN AND RHEUMATIC AND INFLAMMATORY CONDITIONS BY ADMINISTERING THE INDOLES; N-HETERYL IS 2-PIPERAZINYL STERLING WINTHROP INC. (US) 1997-03-04 US disclosed
US-5324737-A Analgesics, antirheumatic and antiinflammatory agents, glaucoma STERLING WINTHROP INC. (US) 1994-06-28 US disclosed
US-5068234-A Analgesics, rheumatic diseases, antiinflammatory agents or antiglaucoma STERLING DRUG INC. (US) 1991-11-26 US disclosed
EP-0444451-A2 3-Arylcarbonyl-1H-indoles useful as therapeutic agents STERLING WINTHROP INC. (US) 1991-09-04 EP disclosed