SCHEMBL744195

SCHEMBL744195

OCCCC1(c2cnc[nH]2)CCc2ccccc21

nearest known ligand 0.42

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ADRA2A P08913 15/20 0.42
ADRA2B P18089 15/20 0.42
ADRA2C P18825 15/20 0.42
ADRA1B P35368 15/20 0.42
TSHR P16473 1/20 0.33
TDP1 Q9NUW8 1/20 0.33

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
SCHEMBL18826052 0.72 ADRA2A (0.55) ADRA2AADRA2BADRA2CADRA1BTSHR
SCHEMBL779503 0.69 ADRA2A (0.46) ADRA2AADRA2BADRA2CADRA1B
SCHEMBL18826070 0.69 ADRA2A (0.68) ADRA2AADRA2BADRA2CADRA1B
SCHEMBL5709449 0.68 SLC6A4 (0.42)
SCHEMBL31683943 0.65 ADRA2A (0.72) ADRA2AADRA2BADRA2CADRA1B
SCHEMBL18826064 0.65 ADRA2A (0.72) ADRA2AADRA2BADRA2CADRA1B
SCHEMBL6881962 0.64 LMNA (0.66) ADRA2A
SCHEMBL7429847 0.64 LMNA (0.42) TSHRTDP1
SCHEMBL11884024 0.63 HDAC9 (0.46) TSHR
SCHEMBL8310700 0.61 TSHR (0.32) TSHR

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-8138179-B2 Spiro-imidazo compounds NOVARTIS AG (CH) 2012-03-20 US disclosed
US-20090192145-A1 Spiro-Imidazo Compounds SPEEDEL EXPERIMENTA AG (CH) 2009-07-30 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-20090192145-A1 Spiro-Imidazo Compounds REN, NR3C2, AGTR1 ADRA2A 138/4885ADRA2B 227/4885ADRA2C 141/4885

“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.