SCHEMBL7155993

SCHEMBL7155993

O=C(O)/C=C\C(=O)NCCCS

nearest known ligand 0.56

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.56
TAAR1 Q96RJ0 6/20 0.54
LMNA P02545 2/20 0.43
CYP2D6 P10635 1/20 0.43
CYP2C19 P33261 1/20 0.43
KMT2A Q03164 2/20 0.42
GAA P10253 2/20 0.38
MAPT P10636 1/20 0.38
TP53 P04637 1/20 0.38
TSHR P16473 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
SCHEMBL7155998 1.00 ALDH1A1 (0.56) ALDH1A1TAAR1LMNACYP2D6CYP2C19
SCHEMBL3064686 0.87 ALDH1A1 (0.52) ALDH1A1TAAR1LMNACYP2D6CYP2C19
SCHEMBL4879990 0.87 ALDH1A1 (0.52) ALDH1A1TAAR1LMNACYP2D6CYP2C19
SCHEMBL10979950 0.87 ALDH1A1 (0.63) ALDH1A1TAAR1LMNACYP2D6CYP2C19
SCHEMBL11133921 0.87 ALDH1A1 (0.63) ALDH1A1TAAR1LMNACYP2D6CYP2C19
SCHEMBL11133917 0.87 ALDH1A1 (0.63) ALDH1A1TAAR1LMNACYP2D6CYP2C19
SCHEMBL11078064 0.87 ALDH1A1 (0.63) ALDH1A1TAAR1LMNACYP2D6CYP2C19
SCHEMBL11142483 0.85 ALDH1A1 (0.61) ALDH1A1TAAR1LMNACYP2D6CYP2C19
SCHEMBL11142756 0.85 ALDH1A1 (0.61) ALDH1A1TAAR1LMNACYP2D6CYP2C19
SCHEMBL11139011 0.85 ALDH1A1 (0.61) ALDH1A1TAAR1LMNACYP2D6CYP2C19

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
WO-2023187106-A1 BARRIERS INCLUDING CROSS-LINKED AMPHIPHILIC MOLECULES, AND METHODS OF MAKING THE SAME ILLUMINA CAMBRIDGE LIMITED (GB) 2023-10-05 WO disclosed
US-10406095-B2 Compositions and methods for protecting bleached hair and enhanced oxidative hair coloring GRANT INDUSTRIES, INC. (US) 2019-09-10 US disclosed
US-20190083380-A1 COMPOSITIONS AND METHODS FOR PROTECTING BLEACHED HAIR AND ENHANCED OXIDATIVE HAIR COLORING GRANT INDUSTRIES, INC. 2019-03-21 US disclosed
US-6534659-B2 Amidation of an acid anhydride by a compound comprising a nitrogen/sulfur saturated ring, e.g., thiazolidine; odorless corrosion inhibitors for metal; pollution control NIPPON SHOKUBAI CO., LTD. (JP) 2003-03-18 US disclosed
US-20010047096-A1 Amidation of an acid anhydride by a compound comprising a nitrogen/sulfur saturated ring, e.g., thiazolidine; odorless corrosion inhibitors for metal; pollution control NIPPON SHOKUBAI CO., LTD. (JP) 2001-11-29 US disclosed
EP-1149833-A1 Sulfidoamidocarboxylic acids used as corrosion inhibitors Nippon Shokubai Co., Ltd. (JP) 2001-10-31 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 (3 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-20190083380-A1 COMPOSITIONS AND METHODS FOR PROTECTING BLEACHED HAIR AND ENHANCED OXIDATIVE HAIR COLORING KRT18, CAT, PRKDC ALDH1A1 885/4885TAAR1 2278/4885LMNA 205/4885
US-10406095-B2 Compositions and methods for protecting bleached hair and enhanced oxidative hair coloring KRT18, CAT, PRKDC ALDH1A1 885/4885TAAR1 2278/4885LMNA 205/4885
US-20010047096-A1 Amidation of an acid anhydride by a compound comprising a nitrogen/sulfur saturated ring, e.g., thiazolidine; odorless corrosion inhibitors for metal; pollution control CTH, TST, SLC7A11 ALDH1A1 1774/4885TAAR1 1898/4885LMNA 4826/4885

“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.