SCHEMBL3048405

SCHEMBL3048405

COc1cc(OC)cc(C(=O)N2CCc3cc(S(N)(=O)=O)c(OC)cc3C2=O)c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 5/20 0.58
CA9 Q16790 5/20 0.58
CA1 P00915 4/20 0.42
CA14 Q9ULX7 4/20 0.42
TSHR P16473 2/20 0.42
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
ALDH1A1 P00352 1/20 0.40
GAA P10253 1/20 0.40
TUBB4A P04350 1/20 0.40
TUBB P07437 1/20 0.40
TUBA3C P0DPH7 1/20 0.40
TUBA1B P68363 1/20 0.40
TUBA4A P68366 1/20 0.40
TUBB4B P68371 1/20 0.40
TUBB3 Q13509 1/20 0.40
TUBB2A Q13885 1/20 0.40
TUBB8 Q3ZCM7 1/20 0.40
TUBA3E Q6PEY2 1/20 0.40
TUBA1A Q71U36 1/20 0.40

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
SCHEMBL3051349 0.91 CA2 (0.63) CA2CA9CA1CA14TSHR
SCHEMBL3052262 0.90 CA2 (0.60) CA2CA9CA1CA14TSHR
SCHEMBL3055432 0.89 CA9 (0.61) CA2CA9CA1CA14MEN1
SCHEMBL3046541 0.86 CA2 (0.78) CA2CA9CA1CA14MEN1
SCHEMBL3054860 0.85 CA2 (0.55) CA2CA9TSHRMEN1KMT2A
SCHEMBL3062616 0.83 CA2 (0.56) CA2CA9CA1CA14KMT2A
SCHEMBL3062610 0.82 CA2 (0.55) CA2CA9CA1CA14MEN1
SCHEMBL3054858 0.82 CA2 (0.53) CA2CA9CA1CA14TSHR
SCHEMBL3048798 0.78 CA1 (0.64) CA2CA9CA1CA14MEN1
SCHEMBL3055755 0.77 P2RX3 (0.47) CA2CA9MEN1KMT2APTGER4

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-8394825-B2 Compound STERIX LIMITED (GB) 2013-03-12 US claimed
US-20100222299-A1 COMPOUND STERIX LIMITED (GB) 2010-09-02 US claimed
EP-2155192-B1 TETRAHYDROISOQUINOLINES AS TUMOUR GROWTH INHIBITORS STERIX LTD (GB) 2016-09-28 EP disclosed
US-8394825-B2 Compound STERIX LIMITED (GB) 2013-03-12 US disclosed
US-20100222299-A1 COMPOUND STERIX LIMITED (GB) 2010-09-02 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-20100222299-A1 COMPOUND MKI67, VHL, MYC CA2 1077/4885CA9 1002/4885CA1 1200/4885

“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.