SCHEMBL9568009

SCHEMBL9568009

O=C(NC(c1ccccc1)c1ccccc1)C1CCCc2ccccc21

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.56
PSMB5 P28074 2/20 0.50
PRMT5 O14744 1/20 0.47
WDR77 Q9BQA1 1/20 0.47
HTT P42858 1/20 0.47
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
CRBN Q96SW2 1/20 0.45
TRPM8 Q7Z2W7 1/20 0.44
KCNQ2 O43526 1/20 0.43
ALDH1A1 P00352 3/20 0.43
CYP2D6 P10635 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.42

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
SCHEMBL9568034 0.82 PSMB5 (0.57) PSMB5PRMT5WDR77HTTALDH1A1
SCHEMBL9567989 0.82 PRMT5 (0.60) PSMB5PRMT5WDR77HTTMEN1
SCHEMBL9568003 0.80 PRMT5 (0.47) PSMB5PRMT5WDR77HTTMEN1
SCHEMBL9568169 0.79 PRMT5 (0.52) PSMB5PRMT5WDR77HTTALDH1A1
SCHEMBL9049008 0.79 LMNA (0.48) LMNAPSMB5MEN1KMT2AALDH1A1
SCHEMBL9269083 0.78 KMT2A (0.62) LMNAPRMT5WDR77HTTMEN1
SCHEMBL31613076 0.78 PRMT5 (0.52) PSMB5PRMT5WDR77HTTMEN1
SCHEMBL31297148 0.78 CRBN (0.49) PRMT5WDR77HTTMEN1KMT2A
SCHEMBL4220276 0.78 CRBN (0.49) PRMT5WDR77HTTMEN1KMT2A
SCHEMBL3412231 0.78 PRMT5 (0.52) PSMB5PRMT5WDR77HTTMEN1

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