SCHEMBL6686745

SCHEMBL6686745

Cc1ccc(S(=O)(=S)OCCO)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.42
RECQL P46063 1/20 0.42
GAA P10253 2/20 0.42
ALDH1A1 P00352 10/20 0.41
MAPT P10636 2/20 0.41
ADAM17 P78536 1/20 0.41
CA1 P00915 3/20 0.40
CA2 P00918 3/20 0.40
MMP1 P03956 1/20 0.40
MMP2 P08253 1/20 0.40
MMP9 P14780 1/20 0.40
MMP8 P22894 1/20 0.40
MMP13 P45452 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
KMT2A Q03164 4/20 0.40
MEN1 O00255 2/20 0.40
CA9 Q16790 2/20 0.39
CA12 O43570 1/20 0.39

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
SCHEMBL31555979 0.89 GAA (0.48) SMN1; SMN2GAAALDH1A1MAPTADAM17
SCHEMBL20595268 0.85 ALDH1A1 (0.47) SMN1; SMN2GAAALDH1A1CA1CA2
SCHEMBL20595296 0.85 ALDH1A1 (0.47) SMN1; SMN2GAAALDH1A1CA1CA2
SCHEMBL8122003 0.84 GAA (0.43) SMN1; SMN2GAAALDH1A1CA1CA2
SCHEMBL10744933 0.84 ALDH1A1 (0.46) SMN1; SMN2RECQLGAAALDH1A1CA1
SCHEMBL1258986 0.81 STAT3 (0.47) SMN1; SMN2RECQLGAAALDH1A1MAPT
SCHEMBL11692308 0.81 CA2 (0.45) SMN1; SMN2RECQLGAAALDH1A1CA1
SCHEMBL11599853 0.79 GAA (0.46) SMN1; SMN2RECQLGAAALDH1A1CA1
SCHEMBL10926820 0.79 CA2 (0.41) GAAALDH1A1CA1CA2CYP3A4
Methoxymethane SCHEMBL14118045 0.79 STAT3 (0.44) SMN1; SMN2RECQLGAAALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6774180-B2 FOR CONJUGATION WITH BIOLOGICALLY ACTIVE AGENT IS SELECTED FROM A PROTEIN, PEPTIDE, CARBOHYDRATE, OLIGONUCLEOTIDE, DNA, RNA, AND LIPID NEKTAR THERAPEUTICS AL, CORPORATION 2004-08-10 US claimed
EP-1345982-A2 SYNTHESIS OF HIGH MOLECULAR WEIGHT NON-PEPTIDIC POLYMER DERIVATIVES Nektar Therapeutics Al, Corporation (US) 2003-09-24 EP claimed
WO-2002059179-A2 SYNTHESIS OF HIGH MOLECULAR WEIGHT NON-PEPTIDIC POLYMER DERIVATIVES SHEARWATER CORPORATION (US) 2002-08-01 WO claimed
US-20020082345-A1 Synthesis of high molecular weight non-peptidic polymer derivatives SHEARWATER CORPORATION 2002-06-27 US claimed

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-20020082345-A1 Synthesis of high molecular weight non-peptidic polymer derivatives ACP1, MRPS27, EPS15 SMN1; SMN2 4457/4885RECQL 4503/4885GAA 626/4885

“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.