SCHEMBL3756898

SCHEMBL3756898

COc1ccccc1-c1nc(S(=O)(=O)c2ccccc2)c(N2CCCCCC2)o1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.84
MAPT P10636 5/20 0.70
ALDH1A1 P00352 6/20 0.67
HPGD P15428 3/20 0.67
NPSR1 Q6W5P4 2/20 0.67
KMT2A Q03164 2/20 0.65
MAPK1 P28482 2/20 0.65
MEN1 O00255 1/20 0.65
PLA2G1B P04054 1/20 0.65
ATG4B Q9Y4P1 1/20 0.65
LMNA P02545 1/20 0.64
TP53 P04637 2/20 0.62
KDM4E B2RXH2 2/20 0.61
GAA P10253 2/20 0.61
TSHR P16473 1/20 0.61
HTT P42858 1/20 0.61
TDP1 Q9NUW8 1/20 0.61
HTR6 P50406 1/20 0.61

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
SCHEMBL7669650 0.83 POLB (0.81) POLBMAPTALDH1A1HPGDNPSR1
SCHEMBL3766151 0.78 TP53 (0.91) POLBMAPTALDH1A1HPGDNPSR1
SCHEMBL7671937 0.78 POLB (1.00) POLBMAPTALDH1A1HPGDNPSR1
SCHEMBL6827361 0.76 HTR6 (0.61) POLBMAPTALDH1A1HPGDNPSR1
Hydrochloric Acid SCHEMBL6829461 0.75 HTR6 (0.60) POLBMAPTALDH1A1HPGDNPSR1
SCHEMBL3756887 0.74 TP53 (1.00) MAPTALDH1A1NPSR1KMT2AMAPK1
SCHEMBL7669051 0.74 HTR6 (0.78) POLBMAPTALDH1A1HPGDKMT2A
SCHEMBL7669890 0.74 ALDH1A1 (1.00) POLBMAPTALDH1A1HPGDNPSR1
SCHEMBL7663455 0.72 ALDH1A1 (1.00) POLBMAPTALDH1A1HPGDNPSR1
SCHEMBL3755285 0.69 L3MBTL1 (0.81) POLBMAPTALDH1A1KMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100305105-A1 PHENYLSULFOXYOXAZOLE COMPOUND INHIBITORS OF UREA TRANSPORTERS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2010-12-02 US claimed
WO-2008061248-A2 PHENYLSULFOXYOXAZOLE COMPOUND INHIBITORS OF UREA TRANSPORTERS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2008-05-22 WO claimed
US-8394788-B2 Phenylsulfoxyoxazole compound inhibitors of urea transporters THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2013-03-12 US disclosed
US-8394788-B2 Phenylsulfoxyoxazole compound inhibitors of urea transporters THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2013-03-12 US disclosed
US-8394788-B2 Phenylsulfoxyoxazole compound inhibitors of urea transporters THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2013-03-12 US disclosed
US-20100305105-A1 PHENYLSULFOXYOXAZOLE COMPOUND INHIBITORS OF UREA TRANSPORTERS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2010-12-02 US disclosed
US-20100305105-A1 PHENYLSULFOXYOXAZOLE COMPOUND INHIBITORS OF UREA TRANSPORTERS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2010-12-02 US disclosed
US-20100305105-A1 PHENYLSULFOXYOXAZOLE COMPOUND INHIBITORS OF UREA TRANSPORTERS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2010-12-02 US disclosed
WO-2008061248-A2 PHENYLSULFOXYOXAZOLE COMPOUND INHIBITORS OF UREA TRANSPORTERS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2008-05-22 WO disclosed
WO-2008061248-A2 PHENYLSULFOXYOXAZOLE COMPOUND INHIBITORS OF UREA TRANSPORTERS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2008-05-22 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-20100305105-A1 PHENYLSULFOXYOXAZOLE COMPOUND INHIBITORS OF UREA TRANSPORTERS SLC14A1, SLCO4C1, SLCO2B1 POLB 2795/4885MAPT 584/4885ALDH1A1 2350/4885

“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.