SCHEMBL9725438

SCHEMBL9725438

CC1CCCCCOC(=O)c2ccc(cc2)C(=O)O1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.36
SMN1; SMN2 Q16637 3/20 0.36
ESR2 Q92731 3/20 0.36
ALDH1A1 P00352 2/20 0.36
HSP90AA1 P07900 2/20 0.36
HSP90AB1 P08238 2/20 0.36
NR1I2 O75469 1/20 0.36
TP53 P04637 1/20 0.36
POLB P06746 1/20 0.36
CYP3A4 P08684 1/20 0.36
MAPT P10636 1/20 0.36
ESR1 P03372 1/20 0.36
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
CA1 P00915 1/20 0.33
CA9 Q16790 1/20 0.33
PRKCA P17252 2/20 0.33
PRKCQ Q04759 2/20 0.33
MAOA P21397 3/20 0.32
MAOB P27338 2/20 0.31

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
SCHEMBL4608729 0.98 LMNA (0.35) LMNASMN1; SMN2ESR2ALDH1A1HSP90AA1
SCHEMBL2477501 0.86 CA1 (0.38) SMN1; SMN2CA1CA9MAOAMAOB
SCHEMBL28411162 0.80 KMT2A (0.32) MEN1KMT2A
SCHEMBL14967792 0.80 ESR1 (0.38) LMNASMN1; SMN2ESR2ALDH1A1HSP90AA1
SCHEMBL597282 0.80 CA1 (0.40) LMNAALDH1A1HSP90AA1HSP90AB1TP53
SCHEMBL4157033 0.80 CA1 (0.40) LMNAALDH1A1HSP90AA1HSP90AB1TP53
SCHEMBL197445 0.80 CA1 (0.40) LMNAALDH1A1HSP90AA1HSP90AB1TP53
SCHEMBL3174046 0.80 CA1 (0.40) LMNAALDH1A1HSP90AA1HSP90AB1TP53
SCHEMBL2483184 0.80 CA1 (0.40) LMNAALDH1A1HSP90AA1HSP90AB1TP53
SCHEMBL28580296 0.80 CA1 (0.40) LMNAALDH1A1HSP90AA1HSP90AB1TP53

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
US-5124224-A Toner compositions and processes with polyethylenes including a linear crystalline polyethylene XEROX CORPORATION (US) 1992-06-23 US claimed
US-5124224-A Toner compositions and processes with polyethylenes including a linear crystalline polyethylene XEROX CORPORATION (US) 1992-06-23 US disclosed