SCHEMBL2264686

SCHEMBL2264686

O=S(=O)(Cl)c1cccc(S(=O)(=O)c2cccc(S(=O)(=O)Cl)c2)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.56
HSD17B10 Q99714 1/20 0.56
TDP1 Q9NUW8 1/20 0.56
LMNA P02545 5/20 0.54
SMN1; SMN2 Q16637 4/20 0.48
KMT2A Q03164 2/20 0.48
TSHR P16473 2/20 0.48
MAPT P10636 2/20 0.48
KDM4E B2RXH2 1/20 0.48
MEN1 O00255 1/20 0.48
NPC1 O15118 1/20 0.48
HPGD P15428 1/20 0.48
RAB9A P51151 1/20 0.48
CA1 P00915 1/20 0.48
CA2 P00918 1/20 0.48
HTR6 P50406 2/20 0.48
HTT P42858 2/20 0.47
GAA P10253 1/20 0.47
THRB P10828 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44

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
SCHEMBL8576301 0.93 ALDH1A1 (0.62) ALDH1A1HSD17B10TDP1LMNASMN1; SMN2
SCHEMBL56599 0.92 ALDH1A1 (0.65) ALDH1A1HSD17B10TDP1LMNASMN1; SMN2
SCHEMBL10633314 0.86 ALDH1A1 (0.51) ALDH1A1HSD17B10TDP1LMNASMN1; SMN2
SCHEMBL1134304 0.81 CA2 (0.77) ALDH1A1HSD17B10TDP1LMNACA1
SCHEMBL364561 0.81 ALDH1A1 (0.52) ALDH1A1HSD17B10TDP1LMNASMN1; SMN2
SCHEMBL6514924 0.81 ALDH1A1 (0.52) ALDH1A1HSD17B10TDP1LMNASMN1; SMN2
SCHEMBL10408548 0.80 ALDH1A1 (0.56) ALDH1A1HSD17B10TDP1LMNANPC1
SCHEMBL28709181 0.79 HTR6 (0.78) ALDH1A1HSD17B10TDP1LMNASMN1; SMN2
SCHEMBL9140147 0.79 HTR6 (0.78) ALDH1A1HSD17B10TDP1LMNASMN1; SMN2
SCHEMBL16000 0.78 ALDH1A1 (0.54) ALDH1A1HSD17B10TDP1KMT2AMEN1

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-8445440-B2 Dimeric IAP inhibitors NOVARTIS AG (CH) 2013-05-21 US disclosed
EP-2539333-A1 DIMERIC IAP INHIBITORS Novartis AG (CH) 2013-01-02 EP disclosed
WO-2011104266-A1 DIMERIC IAP INHIBITORS NOVARTIS AG (CH) 2011-09-01 WO disclosed
US-20110206690-A1 DIMERIC IAP INHIBITORS NOVARTIS AG (CH) 2011-08-25 US disclosed
EP-0019899-B1 DERIVATIVES OF 3,4,5-TRIHYDROXYPIPERIDINE, PROCESSES FOR THEIR PREPARATION, AND THEIR USE AS MEDICINES AND IN ANIMAL FOOD BAYER AG (DE) 1984-07-18 EP disclosed
US-4388246-A THERMAL SPLITTING OF CARBAMATES BAYER AKTIENGESELLSCHAFT (DE) 1983-06-14 US disclosed
EP-0019899-A1 Derivatives of 3,4,5-trihydroxypiperidine, processes for their preparation, and their use as medicines and in animal food BAYER AG (DE) 1980-12-10 EP 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-20110206690-A1 DIMERIC IAP INHIBITORS XIAP, BIRC5, BIRC2 ALDH1A1 4127/4885HSD17B10 3955/4885TDP1 2933/4885

“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.