SCHEMBL3059191

SCHEMBL3059191

COc1cc2c(cc1S(N)(=O)=O)CCN(Cc1cccc(S(N)(=O)=O)c1)C2

nearest known ligand 0.58

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.54
TDP1 Q9NUW8 1/20 0.54
CA2 P00918 3/20 0.53
CA9 Q16790 3/20 0.53
ABCB1 P08183 9/20 0.53
KMT2A Q03164 1/20 0.50
REV1 Q9UBZ9 1/20 0.49
ABCC1 P33527 2/20 0.48
ABCG2 Q9UNQ0 2/20 0.48
MAPT P10636 2/20 0.48
GAA P10253 1/20 0.48
RAB9A P51151 1/20 0.48
ALDH1A1 P00352 1/20 0.47
HTT P42858 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
TAAR1 Q96RJ0 1/20 0.47

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 0.90 DHCR7 (0.58) KDM4ETDP1CA2CA9ABCB1
SCHEMBL3060196 0.90 KDM4E (0.54) KDM4ETDP1CA2CA9ABCB1
SCHEMBL3061675 0.89 REV1 (0.61) KDM4ETDP1CA2CA9ABCB1
SCHEMBL3059179 0.89 KDM4E (0.58) KDM4ETDP1CA2CA9ABCB1
SCHEMBL3041835 0.89 KDM4E (0.53) KDM4ETDP1CA2CA9ABCB1
SCHEMBL3054744 0.89 KMT2A (0.57) KDM4ETDP1CA2CA9ABCB1
SCHEMBL3049199 0.86 REV1 (0.53) KDM4ETDP1CA2CA9ABCB1
SCHEMBL3052643 0.86 KDM4E (0.53) KDM4ETDP1CA2CA9ABCB1
SCHEMBL3042363 0.86 DRD2 (0.52) KDM4ETDP1CA2CA9ABCB1
SCHEMBL3046244 0.86 ABCB1 (0.52) KDM4ETDP1CA2CA9ABCB1

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 7 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
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 KDM4E 1083/4885TDP1 4235/4885CA2 1077/4885

“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.