SCHEMBL3059404

SCHEMBL3059404

COc1cc2c(cc1S(N)(=O)=O)CCN(Cc1cccc(O[Si](C(C)C)(C(C)C)C(C)C)c1)C2

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 2/20 0.47
CA9 Q16790 2/20 0.47
KDM4E B2RXH2 3/20 0.47
TDP1 Q9NUW8 1/20 0.47
DHCR7 Q9UBM7 1/20 0.46
REV1 Q9UBZ9 1/20 0.46
ABCB1 P08183 8/20 0.45
ABCC1 P33527 3/20 0.45
ABCG2 Q9UNQ0 1/20 0.45
KMT2A Q03164 1/20 0.44
MAPT P10636 2/20 0.42
GAA P10253 1/20 0.42
RAB9A P51151 1/20 0.42
CHRM2 P08172 1/20 0.42
HTR1A P08908 1/20 0.42
CHRM3 P20309 1/20 0.42
DRD4 P21917 1/20 0.42
ADRA1D P25100 1/20 0.42
HTR2C P28335 1/20 0.42
ADRA1A P35348 1/20 0.42

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
SCHEMBL3042196 0.89 DHCR7 (0.58) CA2CA9KDM4ETDP1DHCR7
SCHEMBL3061514 0.88 CA2 (0.49) CA2CA9KDM4ETDP1DHCR7
SCHEMBL3046057 0.86 DHCR7 (0.63) CA2CA9KDM4ETDP1DHCR7
SCHEMBL3049199 0.85 REV1 (0.53) CA2CA9KDM4ETDP1DHCR7
SCHEMBL3055597 0.85 REV1 (0.51) CA2CA9KDM4ETDP1DHCR7
SCHEMBL3052573 0.84 KDM4E (0.51) CA2CA9KDM4ETDP1DHCR7
SCHEMBL3064367 0.84 CA2 (0.48) CA2CA9KDM4ETDP1DHCR7
SCHEMBL3059191 0.83 KDM4E (0.54) CA2CA9KDM4ETDP1REV1
SCHEMBL3060196 0.83 KDM4E (0.54) CA2CA9KDM4ETDP1REV1
SCHEMBL3061675 0.83 REV1 (0.61) CA2CA9KDM4ETDP1REV1

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 CA2 1077/4885CA9 1002/4885KDM4E 1083/4885

“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.