SCHEMBL3054657

SCHEMBL3054657

COc1cc2c(cc1OCc1ccccc1)CCN(S(=O)(=O)c1ccccc1OC)C2=O

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 2/20 0.52
GPR84 Q9NQS5 2/20 0.51
HTR2A P28223 2/20 0.46
HTR2C P28335 2/20 0.46
HTR2B P41595 2/20 0.46
HTR1A P08908 1/20 0.46
HTR7 P34969 1/20 0.46
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
REV1 Q9UBZ9 1/20 0.43
TSHR P16473 1/20 0.43
PDE4B Q07343 1/20 0.43
KDM4E B2RXH2 1/20 0.43
GLA P06280 1/20 0.43
RCE1 Q9Y256 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
SCHEMBL3060108 0.86 CHRNA7 (0.50) CHRNA7GPR84HTR2AHTR2CHTR2B
SCHEMBL3051148 0.85 CHRNA7 (0.48) CHRNA7GPR84HTR2AHTR2CHTR2B
SCHEMBL3042255 0.84 CHRNA7 (0.48) CHRNA7GPR84HTR2AHTR2CHTR2B
SCHEMBL3059281 0.82 CHRNA7 (0.46) CHRNA7GPR84HTR2AHTR2CHTR2B
SCHEMBL3061756 0.82 TSHR (0.48) MEN1KMT2ATSHRPDE4B
SCHEMBL3052392 0.80 TSHR (0.47) MEN1KMT2ATSHRPDE4B
SCHEMBL3048205 0.76 ALDH1A1 (0.52) CHRNA7GPR84HTR2AHTR2CHTR2B
SCHEMBL3057161 0.76 MAPK1 (0.55) CHRNA7GPR84HTR2AHTR2CHTR2B
SCHEMBL3041941 0.75 CHRNA7 (0.53) CHRNA7GPR84HTR2AHTR2CHTR2B
SCHEMBL3064135 0.75 REV1 (0.56) CHRNA7GPR84HTR2AHTR2CHTR2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100222299-A1 COMPOUND STERIX LIMITED (GB) 2010-09-02 US claimed
US-8394825-B2 Compound STERIX LIMITED (GB) 2013-03-12 US disclosed
US-20100222299-A1 COMPOUND STERIX LIMITED (GB) 2010-09-02 US disclosed
EP-2155192-A2 TETRAHYDROISOQUINOLINES AS TUMOUR GROWTH INHIBITORS Sterix Limited (GB) 2010-02-24 EP disclosed
WO-2008117061-A2 TETRAHYDROISOQUINOLINES AS TUMOUR GROWTH INHIBITORS STERIX LIMITED (GB) 2008-10-02 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 (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-20100222299-A1 COMPOUND MKI67, VHL, MYC CHRNA7 4760/4885GPR84 2185/4885HTR2A 1257/4885

“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.