SCHEMBL18768446

SCHEMBL18768446

CCN(CC1CC2CCC(C1)N2Cc1ccccc1OC)C(=O)c1cc2ccccc2[nH]1

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 3/20 0.45
▸ KMT2A Q03164 3/20 0.45
▸ CXCR6 O00574 1/20 0.42
▸ FLT3 P36888 1/20 0.40
▸ AKR1C3 P42330 1/20 0.40
▸ KDM4E B2RXH2 3/20 0.40
▸ HPGD P15428 1/20 0.40
▸ HSD17B10 Q99714 1/20 0.40
▸ DRD2 P14416 1/20 0.39
▸ DRD1 P21728 1/20 0.39
▸ DRD4 P21917 1/20 0.39
▸ HTR2C P28335 1/20 0.39
▸ DRD3 P35462 1/20 0.39
▸ GLA P06280 1/20 0.38
▸ CACNA1H O95180 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.38

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
SCHEMBL18768442 0.88 PKM (0.39) AKR1C3KDM4EDRD2DRD4DRD3
SCHEMBL18768630 0.88 KDM4E (0.40) CXCR6AKR1C3KDM4EALDH1A1
SCHEMBL18768626 0.86 MEN1 (0.46) MEN1KMT2AAKR1C3
SCHEMBL18768441 0.86 USP2 (0.47) MEN1KMT2A
SCHEMBL18768445 0.85 PDGFRB (0.44) MEN1KMT2AFLT3DRD2DRD3
SCHEMBL18768577 0.84 DRD2 (0.43) DRD2DRD1DRD4HTR2CDRD3
SCHEMBL18768444 0.83 MDM2 (0.50) DRD2DRD1DRD4HTR2CDRD3
SCHEMBL18768315 0.83 L3MBTL1 (0.47) MEN1KMT2AKDM4EALDH1A1
SCHEMBL18768451 0.81 MDM2 (0.44) DRD2DRD1DRD4HTR2CDRD3
SCHEMBL18768632 0.81 ALDH1A1 (0.43) MEN1KMT2ADRD2DRD1DRD4

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
WO-2017066705-A1 COMPOUNDS, COMPOSITIONS AND METHODS OF USE AGAINST STRESS GRANULES AQUINNAH PHARMACEUTICALS, INC. (US) 2017-04-20 — — WO disclosed
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