SCHEMBL9872208

SCHEMBL9872208

Cc1ccc(S(=O)(=O)OCCCCC(=O)Cl)cc1

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.43
KMT2A Q03164 3/20 0.43
RAB9A P51151 1/20 0.43
PSMD10 O75832 1/20 0.43
STAT3 P40763 2/20 0.43
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39
CA9 Q16790 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
MAPT P10636 1/20 0.39
CTDSP1 Q9GZU7 1/20 0.38
SIRT5 Q9NXA8 1/20 0.38
HTT P42858 1/20 0.38
POLB P06746 1/20 0.38
CYP24A1 Q07973 1/20 0.38
LMNA P02545 1/20 0.37

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
SCHEMBL9764678 0.98 PSMD10 (0.42) ALDH1A1KMT2ARAB9APSMD10STAT3
SCHEMBL9675142 0.98 PSMD10 (0.42) ALDH1A1KMT2ARAB9APSMD10STAT3
SCHEMBL9872763 0.95 PSMD10 (0.44) ALDH1A1KMT2ARAB9APSMD10STAT3
SCHEMBL10860607 0.89 STAT3 (0.46) ALDH1A1KMT2ARAB9APSMD10STAT3
SCHEMBL9709447 0.88 ALDH1A1 (0.51) ALDH1A1KMT2ARAB9APSMD10STAT3
SCHEMBL11217755 0.88 ALDH1A1 (0.45) ALDH1A1KMT2ARAB9APSMD10STAT3
SCHEMBL6238329 0.86 STAT3 (0.47) ALDH1A1KMT2ARAB9APSMD10STAT3
SCHEMBL19386611 0.86 ALDH1A1 (0.44) ALDH1A1KMT2ARAB9APSMD10STAT3
SCHEMBL890725 0.85 ALDH1A1 (0.50) ALDH1A1KMT2APSMD10STAT3CA12
SCHEMBL25030574 0.85 STAT3 (0.46) ALDH1A1KMT2ARAB9APSMD10STAT3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5070139-A PLATELET ACTIVATING FACTOR ANTAGONISTS, HYPOTENSIVES J. URIACH & CIA. S.A. (ES) 1991-12-03 US disclosed
US-4940706-A 2,4-disubstituted 1,3-dioxolanes and pharmaceutical use J. URIACH & CIA, S.A. (ES) 1990-07-10 US disclosed
EP-0312041-A2 2,4-Disubstituted 1,3-dioxolanes J. URIACH & CIA. S.A. (ES) 1989-04-19 EP disclosed