SCHEMBL8250018

SCHEMBL8250018

O=C(O)[C@@H]1CN(C(=O)OCC2c3ccccc3-c3ccccc32)Cc2[nH]c3ccccc3c21

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
FABP5 Q01469 3/20 0.39
FABP7 O15540 2/20 0.39
FAAH O00519 2/20 0.39
TRPV1 Q8NER1 2/20 0.39
KMT2A Q03164 2/20 0.37
CDK4 P11802 2/20 0.37
CCND1 P24385 2/20 0.37
PRMT5 O14744 1/20 0.37
WDR77 Q9BQA1 1/20 0.37
F10 P00742 1/20 0.36
PARP1 P09874 1/20 0.35
PARP2 Q9UGN5 1/20 0.35
TSHR P16473 1/20 0.35
GPX4 P36969 1/20 0.35
CYP19A1 P11511 1/20 0.35
MDM4 O15151 1/20 0.35
TP53 P04637 1/20 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
SCHEMBL8253438 0.89 CYP19A1 (0.41) FABP5KMT2ACDK4CCND1F10
SCHEMBL29929342 0.74 ACE (0.60) CYP19A1
SCHEMBL799730 0.74 ACE (0.60) CYP19A1
SCHEMBL17500271 0.73 MAPT (0.39) FAAHTRPV1KMT2ACDK4CCND1
SCHEMBL19161127 0.73 MAPT (0.39) FAAHTRPV1KMT2ACDK4CCND1
SCHEMBL19168622 0.73 MAPT (0.39) FAAHTRPV1KMT2ACDK4CCND1
SCHEMBL119453 0.73 FABP5 (0.52) FABP5FABP7KMT2AF10TSHR
SCHEMBL12660672 0.72 KDM4E (0.46) CYP19A1
SCHEMBL29341819 0.70 FABP5 (0.55) FABP5FABP7KMT2AF10TSHR
SCHEMBL4709998 0.70 FABP5 (0.49) FABP5FABP7KMT2AF10TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140163042-A1 ENZYME INHIBITORS CHROMA THERAPEUTICS LTD. (GB) 2014-06-12 US disclosed
US-20130116318-A1 Enzyme Inhibitors CHROMA THERAPEUTICS LTD. (GB) 2013-05-09 US disclosed
US-7939666-B2 Enzyme inhibitors CHROMA THERAPEUTICS LTD. (GB) 2011-05-10 US disclosed
EP-2301939-A1 Enzyme inhibitors Chroma Therapeutics Limited (GB) 2011-03-30 EP disclosed
US-20090291978-A1 Enzyme Inhibitors CHROMA THERAPEUTICS LTD. (GB) 2009-11-26 US disclosed
WO-2006117549-A1 ENZYME INHIBITORS CHROMA THERAPEUTICS LTD (GB) 2006-11-09 WO 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 (3 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-20130116318-A1 Enzyme Inhibitors HDAC1, HDAC11, HDAC7 FABP5 2422/4885FABP7 2644/4885FAAH 2797/4885
US-20140163042-A1 ENZYME INHIBITORS HAT1, NR2E1, HDAC3 FABP5 3382/4885FABP7 3328/4885FAAH 1454/4885
US-20090291978-A1 Enzyme Inhibitors HAT1, NR2E1, NR2C2 FABP5 3963/4885FABP7 3726/4885FAAH 1664/4885

“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.