SCHEMBL9568034

SCHEMBL9568034

O=C(NC(Cc1ccccc1)c1ccccc1)C1CCCc2ccccc21

nearest known ligand 0.57

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PSMB5 P28074 9/20 0.57
ALDH1A1 P00352 1/20 0.47
HTT P42858 1/20 0.47
NCOA1 Q15788 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
NCOA3 Q9Y6Q9 1/20 0.47
CCR3 P51677 1/20 0.45
PRMT5 O14744 1/20 0.45
WDR77 Q9BQA1 1/20 0.45
F11 P03951 1/20 0.44

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
SCHEMBL9568009 0.82 LMNA (0.56) PSMB5ALDH1A1HTTSMN1; SMN2PRMT5
SCHEMBL9049799 0.82 F11 (0.42) PSMB5ALDH1A1HTTNCOA1SMN1; SMN2
SCHEMBL9568008 0.81 ALDH1A1 (0.51) PSMB5ALDH1A1HTTNCOA1SMN1; SMN2
SCHEMBL9567979 0.80 ALDH1A1 (0.49) PSMB5ALDH1A1HTTNCOA1SMN1; SMN2
SCHEMBL8858477 0.79 PTGIR (0.52) F11
SCHEMBL9567989 0.79 PRMT5 (0.60) PSMB5ALDH1A1HTTPRMT5WDR77
SCHEMBL7398455 0.77 ALDH1A1 (0.57) PSMB5ALDH1A1HTTPRMT5WDR77
SCHEMBL9568169 0.76 PRMT5 (0.52) PSMB5ALDH1A1HTTPRMT5WDR77
SCHEMBL9568003 0.74 PRMT5 (0.47) PSMB5ALDH1A1HTTPRMT5WDR77
SCHEMBL9269083 0.72 KMT2A (0.62) HTTPRMT5WDR77

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
EP-0542203-A2 Fused benzeneoxyacetic acid derivatives as PGl2 receptor agonists ONO PHARMACEUTICAL CO., LTD. (JP) 1993-05-19 EP disclosed