SCHEMBL18768451

SCHEMBL18768451

CCN(CC1CC2CCC(C1)N2Cc1cccc(Cl)c1)C(=O)c1cc2ccccc2[nH]1

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ MDM2 Q00987 1/20 0.44
▸ USP2 O75604 1/20 0.41
▸ JAK2 O60674 1/20 0.40
▸ JAK1 P23458 1/20 0.40
▸ TYK2 P29597 1/20 0.40
▸ DRD2 P14416 1/20 0.40
▸ DRD1 P21728 1/20 0.40
▸ DRD4 P21917 1/20 0.40
▸ HTR2C P28335 1/20 0.40
▸ DRD3 P35462 1/20 0.40
▸ OPRM1 P35372 2/20 0.39
▸ OPRD1 P41143 1/20 0.39
▸ OPRK1 P41145 1/20 0.39
▸ KCNH2 Q12809 1/20 0.39

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
SCHEMBL18768441 0.93 USP2 (0.47) MDM2USP2OPRM1OPRD1OPRK1
SCHEMBL18768444 0.92 MDM2 (0.50) MDM2USP2DRD2DRD1DRD4
SCHEMBL18768632 0.90 ALDH1A1 (0.43) USP2DRD2DRD1DRD4HTR2C
SCHEMBL18768445 0.88 PDGFRB (0.44) JAK2JAK1TYK2DRD2DRD3
SCHEMBL18768577 0.88 DRD2 (0.43) MDM2USP2DRD2DRD1DRD4
SCHEMBL18768630 0.86 KDM4E (0.40) MDM2OPRM1OPRD1
SCHEMBL18768442 0.82 PKM (0.39) DRD2DRD4DRD3
SCHEMBL18768446 0.81 MEN1 (0.45) DRD2DRD1DRD4HTR2CDRD3
SCHEMBL18768434 0.78 — —
SCHEMBL18767437 0.78 MDM2 (0.43) MDM2DRD2DRD1DRD4HTR2C

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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