SCHEMBL2909667

SCHEMBL2909667

CCSN(SCC)C(=S)Cc1ccc(C(=O)O)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.49
ALDH2 P05091 1/20 0.49
RARB P10826 6/20 0.41
KMT2A Q03164 5/20 0.39
MEN1 O00255 3/20 0.39
MAPT P10636 2/20 0.39
RXRA P19793 2/20 0.39
RXRB P28702 2/20 0.39
RARA P10276 1/20 0.39
MTOR P42345 1/20 0.39
SRD5A2 P31213 3/20 0.38
POLB P06746 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
KDM4E B2RXH2 1/20 0.38
USP2 O75604 1/20 0.38
GAA P10253 1/20 0.38
THRB P10828 1/20 0.38
NR4A1 P22736 1/20 0.38
APEX1 P27695 1/20 0.38
APOBEC3A P31941 1/20 0.38

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
Hydrochloric Acid SCHEMBL2909153 0.98 ALDH1A1 (0.48) ALDH1A1ALDH2RARBKMT2AMEN1
SCHEMBL5654877 0.82 ALDH1A1 (0.42) ALDH1A1MAPTPOLBTDP1L3MBTL1
SCHEMBL4811989 0.80 ALDH1A1 (0.46) ALDH1A1ALDH2RARBKMT2AMEN1
Bromide SCHEMBL3797608 0.75 KDM4E (0.35) ALDH1A1KDM4ETDP1
SCHEMBL11570423 0.74 ALDH1A1 (0.49) ALDH1A1ALDH2KMT2AMEN1MAPT
SCHEMBL2912497 0.73 FOLH1 (0.41) ALDH1A1MAPTPOLBGAAHIF1A
Hydrochloric Acid SCHEMBL2907706 0.72 FOLH1 (0.41) ALDH1A1MAPTPOLBGAAHIF1A
SCHEMBL2912099 0.72 LOXL2 (0.40) ALDH1A1MAPTSMN1; SMN2KDM4ELMNA
SCHEMBL1063942 0.69 ALDH1A1 (0.52) ALDH1A1ALDH2KMT2AMEN1MAPT
SCHEMBL3367595 0.69 ALDH1A1 (0.63) ALDH1A1RARBKMT2AMEN1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8507659-B2 Method for chemically modifying biopolymer and polypeptide FUJIFILM CORPORATION (JP) 2013-08-13 US claimed
EP-2221334-B1 METHOD FOR CHEMICALLY MODIFYING BIOPOLYMER AND POLYPEPTIDE FUJIFILM CORP (JP) 2016-12-28 EP disclosed
US-8507659-B2 Method for chemically modifying biopolymer and polypeptide FUJIFILM CORPORATION (JP) 2013-08-13 US disclosed
US-20120315265-A1 HYDROGEL-FORMING POLYMER, AND PREPARATION PROCESS AND USES THEREOF CHANG GUNG UNIVERSITY (TW) 2012-12-13 US disclosed
US-20100323421-A1 METHOD FOR CHEMICALLY MODIFYING BIOPOLYMER AND POLYPEPTIDE FUJIFILM CORPORATION (JP) 2010-12-23 US disclosed
EP-2221334-A1 METHOD FOR CHEMICALLY MODIFYING BIOPOLYMER OR POLYPEPTIDE FUJIFILM Corporation (JP) 2010-08-25 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-20120315265-A1 HYDROGEL-FORMING POLYMER, AND PREPARATION PROCESS AND USES THEREOF PDE6H, PDE6D, PDE6C ALDH1A1 501/4885ALDH2 361/4885RARB 2727/4885

“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.