SCHEMBL5492960

SCHEMBL5492960

CCCCC(=O)OCCc1cc(OCC)c(OCC)cc1C(=O)c1cc2ccccc2s1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 1/20 0.42
L3MBTL1 Q9Y468 2/20 0.40
CNR1 P21554 1/20 0.40
CNR2 P34972 1/20 0.40
NPY2R P49146 1/20 0.38
ALDH1A1 P00352 2/20 0.37
CLK1 P49759 2/20 0.37
KDM4E B2RXH2 1/20 0.37
HSD17B10 Q99714 1/20 0.37
DYRK1A Q13627 1/20 0.35
HDAC3 O15379 2/20 0.35
HDAC4 P56524 2/20 0.35
HDAC1 Q13547 2/20 0.35
HDAC7 Q8WUI4 2/20 0.35
HDAC2 Q92769 2/20 0.35
HDAC10 Q969S8 2/20 0.35
HDAC11 Q96DB2 2/20 0.35
HDAC8 Q9BY41 2/20 0.35
HDAC6 Q9UBN7 2/20 0.35
HDAC9 Q9UKV0 2/20 0.35

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
SCHEMBL5485183 0.81 CNR1 (0.45) RAB9AL3MBTL1CNR1CNR2ALDH1A1
SCHEMBL6614544 0.73 CNR1 (0.48) RAB9ACNR1CNR2CLK1DYRK1A
SCHEMBL6613994 0.71 CNR1 (0.44) RAB9ACNR1CNR2CLK1DYRK1A
SCHEMBL7407952 0.71 CNR1 (0.45) RAB9ACNR1CNR2CLK1DYRK1A
SCHEMBL5492931 0.69 NAMPT (0.50) RAB9ACNR1CNR2CLK1DYRK1A
SCHEMBL16020824 0.68 RAB9A (0.46) RAB9ACNR1CNR2NPY2RCLK1
SCHEMBL16020816 0.67 RAB9A (0.46) RAB9ACNR1CNR2CLK1DYRK1A
SCHEMBL5935775 0.66 RAB9A (0.56) RAB9AL3MBTL1CNR2ALDH1A1KDM4E
SCHEMBL16673031 0.65 CYP4F2 (0.51) L3MBTL1ALDH1A1KDM4ETDP1
SCHEMBL4405770 0.64 BCL2L1 (0.57) RAB9AL3MBTL1CNR1CNR2ALDH1A1

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-7250410-B2 Cyclic nucleotide phosphodiesterase inhibitors, preparation and uses thereof VIA PHARMACEUTICALS, INC. (US) 2007-07-31 US disclosed
US-20040152888-A1 Cyclic nucleotide phosphodiesterase inhibitors, preparation and uses thereof BAY CITY CAPITAL LLC 2004-08-05 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20040152888-A1 Cyclic nucleotide phosphodiesterase inhibitors, preparation and uses thereof PDE7A, PDE3B, PDE3A RAB9A 1379/4885L3MBTL1 4834/4885CNR1 101/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.