SCHEMBL1355474

SCHEMBL1355474

CCN(C(=O)c1ccc(Br)c(Cl)c1)C1CCCCC1

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 3/20 0.52
TSHR P16473 1/20 0.51
BRD4 O60885 1/20 0.49
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
ADORA2A P29274 3/20 0.47
AGER Q15109 1/20 0.46
LMNA P02545 2/20 0.45
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
CCR5 P51681 1/20 0.44
ITK Q08881 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.43
SLC6A9 P48067 1/20 0.43
SLC6A5 Q9Y345 1/20 0.43

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
SCHEMBL28148662 0.88 HSD11B1 (0.55) HSD11B1TSHRBRD4MEN1KMT2A
SCHEMBL1355453 0.86 HSD11B1 (0.53) HSD11B1TSHRBRD4MEN1KMT2A
SCHEMBL1353254 0.85 HSD11B1 (0.55) HSD11B1TSHRBRD4MEN1KMT2A
SCHEMBL1355162 0.84 TSHR (0.53) HSD11B1TSHRBRD4ADORA2AAGER
SCHEMBL1355477 0.83 TSHR (0.53) HSD11B1TSHRBRD4MEN1KMT2A
SCHEMBL1354744 0.82 TSHR (0.61) HSD11B1TSHRBRD4MEN1KMT2A
SCHEMBL10722280 0.82 HSD11B1 (0.70) HSD11B1TSHRBRD4MEN1KMT2A
SCHEMBL1355172 0.81 KMT2A (0.49) HSD11B1TSHRBRD4MEN1KMT2A
SCHEMBL9540877 0.80 SLC6A9 (0.47) HSD11B1TSHRMEN1KMT2ALMNA
SCHEMBL10720234 0.79 HSD11B1 (0.56) HSD11B1TSHRBRD4MEN1KMT2A

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-9029393-B2 Adenosine receptor ligands and uses thereof KALDI PHARMA, SAS (FR) 2015-05-12 US disclosed
EP-2391625-B1 New adenosine receptor ligands and uses thereof DOMAIN THERAPEUTICS (FR) 2013-05-01 EP disclosed
EP-2391625-A1 NEW ADENOSINE RECEPTOR LIGANDS AND USES THEREOF Domain Therapeutics (FR) 2011-12-07 EP disclosed
US-20110288074-A1 NEW ADENOSINE RECEPTOR LIGANDS AND USES THEREOF DOMAIN THERAPEUTICS (FR) 2011-11-24 US disclosed
WO-2010084425-A1 NEW ADENOSINE RECEPTOR LIGANDS AND USES THEREOF DOMAIN THERAPEUTICS (FR) 2010-07-29 WO disclosed
EP-2210891-A1 New adenosine receptor ligands and uses thereof Domain Therapeutics (FR) 2010-07-28 EP 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-20110288074-A1 NEW ADENOSINE RECEPTOR LIGANDS AND USES THEREOF ADORA2A, ADORA1, ADORA2B HSD11B1 2224/4885TSHR 650/4885BRD4 3621/4885

“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.