SCHEMBL17030883

SCHEMBL17030883

Cc1ccc(S(=O)(=O)CP(=O)(c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 1/20 0.51
ALDH1A1 P00352 5/20 0.49
TP53 P04637 1/20 0.49
TDP1 Q9NUW8 1/20 0.49
RECQL P46063 1/20 0.49
CYP3A4 P08684 2/20 0.47
CYP2C9 P11712 1/20 0.47
CYP2C19 P33261 1/20 0.47
HTT P42858 1/20 0.46
HSD11B1 P28845 1/20 0.45
GAA P10253 2/20 0.43
KMT2A Q03164 2/20 0.43
L3MBTL1 Q9Y468 2/20 0.42
BCHE P06276 1/20 0.42
ACHE P22303 1/20 0.42
CA12 O43570 1/20 0.42
CYP1A2 P05177 1/20 0.42
ATM Q13315 1/20 0.42
CA9 Q16790 1/20 0.42
PSIP1 O75475 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
SCHEMBL14589668 0.83 MCHR1 (0.51) MCHR1ALDH1A1TP53TDP1RECQL
SCHEMBL1866694 0.76 ALDH1A1 (0.46) MCHR1ALDH1A1RECQLHTTGAA
SCHEMBL4401126 0.75 GAA (0.59) ALDH1A1CYP3A4CYP2C9CYP2C19HTT
SCHEMBL16346863 0.74 ALDH1A1 (0.53) ALDH1A1TP53TDP1RECQLCYP3A4
SCHEMBL4112137 0.73 LMNA (0.52) MCHR1ALDH1A1TP53TDP1RECQL
SCHEMBL28646256 0.73 CA12 (0.46) MCHR1ALDH1A1TP53TDP1CYP3A4
SCHEMBL9083678 0.71 ALDH1A1 (0.50) ALDH1A1TP53TDP1RECQLCYP3A4
SCHEMBL16346612 0.71 ALDH1A1 (0.50) ALDH1A1TP53TDP1RECQLCYP3A4
SCHEMBL257997 0.71 MAPT (0.64) MCHR1ALDH1A1TP53TDP1RECQL
SCHEMBL20462898 0.71 CYP3A4 (0.58) ALDH1A1CYP3A4CYP2C19HTTGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9295983-B2 Calixarene-bound iridium-containing metal colloids THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2016-03-29 US disclosed
US-20150238949-A1 CALIXARENE-BOUND IRIDIUM-CONTAINING METAL COLLOIDS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2015-08-27 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-20150238949-A1 CALIXARENE-BOUND IRIDIUM-CONTAINING METAL COLLOIDS CALR, CALD1, CALU MCHR1 1241/4885ALDH1A1 1391/4885TP53 979/4885

“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.