SCHEMBL20528274

SCHEMBL20528274

CCOC(=O)C(N)CS(=O)(=O)O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.39
ALOX15 P16050 1/20 0.39
ALDH1A1 P00352 3/20 0.37
CA12 O43570 2/20 0.36
CA1 P00915 2/20 0.36
CA2 P00918 2/20 0.36
CA9 Q16790 2/20 0.36
LMNA P02545 1/20 0.36
HSD17B10 Q99714 1/20 0.36
CYP2D6 P10635 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
MGAM O43451 1/20 0.34
GAA P10253 1/20 0.34
SI P14410 1/20 0.34
MGAM2 Q2M2H8 1/20 0.34
SOAT1 P35610 1/20 0.34
MEN1 O00255 1/20 0.33
NPC1 O15118 1/20 0.33
KMT2A Q03164 1/20 0.33

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
SCHEMBL951149 1.00 TP53 (0.39) TP53ALOX15ALDH1A1CA12CA1
Hydrochloric Acid SCHEMBL2212116 0.98 TP53 (0.38) TP53ALOX15ALDH1A1CA12CA1
Hydrochloric Acid SCHEMBL2212113 0.98 TP53 (0.38) TP53ALOX15ALDH1A1CA12CA1
SCHEMBL6433997 0.84 TP53 (0.37) TP53ALDH1A1CA1CA2LMNA
SCHEMBL27594511 0.82 ALOX15 (0.38) TP53ALOX15ALDH1A1CA12CA1
SCHEMBL20528273 0.82 TP53 (0.38) TP53ALOX15ALDH1A1CA12CA1
SCHEMBL27594510 0.82 ALOX15 (0.38) TP53ALOX15ALDH1A1CA12CA1
SCHEMBL3766175 0.81 CA14 (0.39) TP53ALDH1A1CA12CA1CA2
SCHEMBL1786590 0.81 CA14 (0.39) TP53ALDH1A1CA12CA1CA2
SCHEMBL1786589 0.81 CA14 (0.39) TP53ALDH1A1CA12CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-100360502-C Retinol derivatives, their use in the treatment of cancer and for potentiating the efficacy of other cytotoxic agents ARDENIA INVESTMENTS LTD (GB) 2008-01-09 CN claimed
CN-1668583-A Retinol derivatives, their use in the treatment of cancer and for enhancing the efficacy of other cytotoxic agents ARDENIA INVESTMENTS LTD (GB) 2005-09-14 CN claimed
CN-111920967-B Technetium [ 99m Tc]Double-cysteine ethyl ester injection and marking process thereof 北京森科医药有限公司 2023-04-28 CN disclosed
EP-3386947-B1 METHOD FOR PRODUCING N-RETINOYLAMINOALKANE SULFONIC ACID OASMIA PHARMACEUTICAL AB (SE) 2021-05-19 EP disclosed
US-10322996-B2 Method for producing N-retinoylcysteic acid alkyl ester ARDENIA INVESTMENTS, LTD (GB) 2019-06-18 US disclosed
US-20190127322-A1 METHOD FOR PRODUCING N-RETINOYLCYSTEIC ACID ALKYL ESTER VIVESTO AB (SE) 2019-05-02 US disclosed
US-10138204-B2 Method for producing N-retinoylcysteic acid alkyl ester ARDENIA INVESTMENTS, LTD (GB) 2018-11-27 US disclosed
US-20180290973-A1 METHOD FOR PRODUCING N-RETINOYLCYSTEIC ACID ALKYL ESTER VIVESTO AB (SE) 2018-10-11 US disclosed
CN-100360502-C Retinol derivatives, their use in the treatment of cancer and for potentiating the efficacy of other cytotoxic agents ARDENIA INVESTMENTS LTD (GB) 2008-01-09 CN disclosed
CN-1668583-A Retinol derivatives, their use in the treatment of cancer and for enhancing the efficacy of other cytotoxic agents ARDENIA INVESTMENTS LTD (GB) 2005-09-14 CN 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 (4 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-20190127322-A1 METHOD FOR PRODUCING N-RETINOYLCYSTEIC ACID ALKYL ESTER AHCY, LRAT, RARA TP53 3450/4885ALOX15 237/4885ALDH1A1 225/4885
US-20180290973-A1 METHOD FOR PRODUCING N-RETINOYLCYSTEIC ACID ALKYL ESTER AHCY, LRAT, RARA TP53 3450/4885ALOX15 237/4885ALDH1A1 225/4885
US-10138204-B2 Method for producing N-retinoylcysteic acid alkyl ester AHCY, LRAT, RARA TP53 3450/4885ALOX15 237/4885ALDH1A1 225/4885
US-10322996-B2 Method for producing N-retinoylcysteic acid alkyl ester AHCY, LRAT, RARA TP53 3450/4885ALOX15 237/4885ALDH1A1 225/4885

“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.