SCHEMBL5470263

SCHEMBL5470263

O=C(O)C(S)OC(S)C(=O)NCCO

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.47
▸ MAPT P10636 2/20 0.47
▸ MEN1 O00255 1/20 0.47
▸ USP2 O75604 1/20 0.47
▸ KMT2A Q03164 1/20 0.47
▸ CYP3A4 P08684 1/20 0.37
▸ TSHR P16473 1/20 0.37
▸ LMNA P02545 1/20 0.31
▸ PTGS2 P35354 1/20 0.31
▸ TDP1 Q9NUW8 1/20 0.31
▸ CHRNB2 P17787 1/20 0.30
▸ CHRNB4 P30926 1/20 0.30
▸ CHRNA3 P32297 1/20 0.30
▸ CHRNA4 P43681 1/20 0.30

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
SCHEMBL5465866 0.92 ALDH1A1 (0.54) ALDH1A1MAPTMEN1USP2KMT2A
SCHEMBL5466128 0.83 USP2 (0.36) ALDH1A1MAPTMEN1USP2KMT2A
SCHEMBL5470269 0.80 FNTA (0.43) LMNA
SCHEMBL5473337 0.80 LAP3 (0.43) ALDH1A1MAPTLMNAPTGS2TDP1
SCHEMBL5469548 0.80 DNM1 (0.40) TSHR
SCHEMBL5471966 0.79 ALDH1A1 (0.36) ALDH1A1MEN1USP2KMT2ATSHR
SCHEMBL5466084 0.78 ACE (0.36) ALDH1A1MAPTUSP2TSHRLMNA
SCHEMBL5465853 0.76 CYP2C19 (0.47) ALDH1A1MAPTMEN1KMT2ALMNA
SCHEMBL5469964 0.74 ALDH1A1 (0.36) ALDH1A1MAPTMEN1KMT2ALMNA
SCHEMBL5463173 0.74 ALDH1A1 (0.52) ALDH1A1MAPTMEN1USP2KMT2A

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-20070009462-A9 Composition to permanently reshape the hair containing at least one dicarboxydithiol MALLE GERARD 2007-01-11 — — US claimed
US-20050201964-A1 Composition to permanently reshape the hair containing at least one dicarboxydithiol L'OREAL S.A. (FR) 2005-09-15 — — US claimed
US-20070009462-A9 Composition to permanently reshape the hair containing at least one dicarboxydithiol MALLE GERARD 2007-01-11 — — US disclosed
US-20050201964-A1 Composition to permanently reshape the hair containing at least one dicarboxydithiol L'OREAL S.A. (FR) 2005-09-15 — — US 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 (2 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-20050201964-A1 Composition to permanently reshape the hair containing at least one dicarboxydithiol NR5A1, SRD5A2, HRH3 ALDH1A1 792/4885MAPT 3323/4885MEN1 665/4885
US-20070009462-A9 Composition to permanently reshape the hair containing at least one dicarboxydithiol NR5A1, SRD5A2, HRH3 ALDH1A1 792/4885MAPT 3323/4885MEN1 665/4885

“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.

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