SCHEMBL1593389

SCHEMBL1593389

O=C1C2CC3CC1CC(OC(=O)C(F)(F)S(=O)(=O)OS(c1ccccc1)(c1ccccc1)c1ccccc1)(C3)C2

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
CYP17A1 P05093 1/20 0.35
CYP19A1 P11511 1/20 0.35
CASR P41180 1/20 0.32
ENPP3 O14638 1/20 0.32
CA2 P00918 1/20 0.32
ENPP1 P22413 1/20 0.32
ENPP2 Q13822 1/20 0.32
CA9 Q16790 1/20 0.32
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
KMT2A Q03164 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
EPHX2 P34913 1/20 0.31
ALDH1A1 P00352 1/20 0.30
GAA P10253 1/20 0.30

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
SCHEMBL16566543 0.92 CYP19A1 (0.40) NPSR1CYP17A1CYP19A1CASRENPP3
SCHEMBL1146838 0.82 DPP8 (0.34) CYP17A1CYP19A1ENPP3CA2ENPP1
SCHEMBL10150820 0.79 TSHR (0.38) TSHRNPSR1CYP17A1CYP19A1CASR
SCHEMBL19261603 0.78 TSHR (0.52) TSHRNPSR1CYP17A1CYP19A1CA2
SCHEMBL547287 0.78 TSHR (0.52) TSHRNPSR1CYP17A1CYP19A1CA2
SCHEMBL16131651 0.78 TSHR (0.49) TSHRNPSR1CYP17A1CYP19A1CA2
SCHEMBL13495412 0.78 TSHR (0.36) TSHRNPSR1CYP17A1CYP19A1CASR
SCHEMBL546868 0.77 TSHR (0.41) TSHRNPSR1CYP17A1CYP19A1CASR
SCHEMBL10150821 0.77 TSHR (0.51) TSHRNPSR1CYP17A1CYP19A1CA2
SCHEMBL13495437 0.76 TSHR (0.44) TSHRNPSR1CYP17A1CYP19A1EPHX2

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-8530137-B2 Photoresist composition SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2013-09-10 US disclosed
US-8426106-B2 Photoresist composition SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2013-04-23 US disclosed
US-8304164-B2 Photoresist composition SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-11-06 US disclosed
US-20110200935-A1 PHOTORESIST COMPOSITION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-08-18 US disclosed
US-20110171575-A1 PHOTORESIST COMPOSITION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-07-14 US disclosed
US-20110091807-A1 PHOTORESIST COMPOSITION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-04-21 US disclosed
US-20110091808-A1 PHOTORESIST COMPOSITION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-04-21 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 (3 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-20110091808-A1 PHOTORESIST COMPOSITION ASIC1, ASIC3, SUN2 TSHR 4266/4885NPSR1 1095/4885CYP17A1 4438/4885
US-20110200935-A1 PHOTORESIST COMPOSITION C1R, F12, C1S TSHR 2611/4885NPSR1 634/4885CYP17A1 2578/4885
US-20110091807-A1 PHOTORESIST COMPOSITION H1-0, H1-2, H1-3 TSHR 3037/4885NPSR1 1340/4885CYP17A1 3232/4885

“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.