SCHEMBL8650604

SCHEMBL8650604

C=CCN1CCC(O)CC1=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APEX1 P27695 1/20 0.39
BLM P54132 1/20 0.39
MEN1 O00255 1/20 0.34
ALDH1A1 P00352 1/20 0.34
KMT2A Q03164 1/20 0.34
CYP3A4 P08684 1/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
HSD17B10 Q99714 1/20 0.32
HDAC3 O15379 1/20 0.32
HDAC4 P56524 1/20 0.32
HDAC1 Q13547 1/20 0.32
HDAC7 Q8WUI4 1/20 0.32
HDAC2 Q92769 1/20 0.32
HDAC10 Q969S8 1/20 0.32
HDAC11 Q96DB2 1/20 0.32
HDAC8 Q9BY41 1/20 0.32
HDAC6 Q9UBN7 1/20 0.32
HDAC9 Q9UKV0 1/20 0.32
HDAC5 Q9UQL6 1/20 0.32

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
SCHEMBL11501308 0.95 APEX1 (0.36) APEX1BLMMEN1ALDH1A1KMT2A
SCHEMBL10628769 0.81 APEX1 (0.53) APEX1BLMMEN1ALDH1A1KMT2A
SCHEMBL8650915 0.77 BRD4 (0.42) MEN1ALDH1A1KMT2AHSD17B10
SCHEMBL8650913 0.76 FAAH (0.38) HSD17B10
SCHEMBL1551140 0.74 CYP3A4 (0.35) MEN1ALDH1A1KMT2ACYP3A4HDAC3
SCHEMBL25886785 0.71 APEX1 (0.39) APEX1BLMNPC1RAB9A
SCHEMBL1574459 0.70 CYP1A2 (0.44) MEN1ALDH1A1KMT2ADRD2
SCHEMBL9081577 0.70
SCHEMBL9000514 0.68 CYP3A4 (0.37) MEN1ALDH1A1KMT2ACYP3A4HDAC3
SCHEMBL30762 0.67

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5851274-A Ink jet ink compositions and processes for high resolution and high speed printing XEROX CORPORATION (US) 1998-12-22 US claimed
EP-0853108-A1 Ink jet ink compositions and processes for high resolution and high speed printing XEROX CORPORATION (US) 1998-07-15 EP claimed
US-5851274-A Ink jet ink compositions and processes for high resolution and high speed printing XEROX CORPORATION (US) 1998-12-22 US disclosed
EP-0853108-A1 Ink jet ink compositions and processes for high resolution and high speed printing XEROX CORPORATION (US) 1998-07-15 EP disclosed