SCHEMBL23964452

SCHEMBL23964452

C=C(CC(=O)NC(C)(C)C)SC(C)(C)C

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.37
ALDH1A1 P00352 2/20 0.36
SMN1; SMN2 Q16637 3/20 0.35
HPGD P15428 2/20 0.34
LMNA P02545 3/20 0.33
HDAC2 Q92769 1/20 0.33
NPC1 O15118 2/20 0.33
GAA P10253 1/20 0.33
MAPT P10636 2/20 0.31
TSHR P16473 1/20 0.31
CASP3 P42574 1/20 0.30
SENP8 Q96LD8 1/20 0.30
SENP7 Q9BQF6 1/20 0.30
SENP6 Q9GZR1 1/20 0.30
CA1 P00915 1/20 0.30
CA2 P00918 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
SCHEMBL26568239 0.76 POLB (0.35) POLBALDH1A1SMN1; SMN2HPGDLMNA
SCHEMBL26568498 0.76 TSHR (0.38) POLBALDH1A1SMN1; SMN2HPGDTSHR
SCHEMBL18026348 0.74 ALDH1A1 (0.47) POLBALDH1A1SMN1; SMN2HPGDLMNA
SCHEMBL18860307 0.73 ALDH1A1 (0.44) POLBALDH1A1SMN1; SMN2HPGDLMNA
SCHEMBL23869689 0.71 ALDH1A1 (0.39) POLBALDH1A1SMN1; SMN2HPGDLMNA
SCHEMBL922696 0.67 ALDH1A1 (0.47) POLBALDH1A1SMN1; SMN2HPGDLMNA
SCHEMBL9910982 0.67 EPHX1 (0.36) POLB
SCHEMBL5318521 0.67
SCHEMBL13618809 0.67 MAPT (0.44) POLBALDH1A1SMN1; SMN2HPGDLMNA
SCHEMBL15498202 0.67 POLB (0.48) POLBALDH1A1SMN1; SMN2HPGDLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230330245-A1 ANTIBODY-EXATECAN CONJUGATES SYNAFFIX B.V. (NL) 2023-10-19 US disclosed
US-20210338834-A1 DEGRADABLE HYALURONIC ACID HYDROGELS ASCENDIS PHARMA A/S (DK) 2021-11-04 US disclosed
US-20210330798-A1 TREATMENT OF INFECTIONS ASCENDIS PHARMA A/S (DK) 2021-10-28 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 (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-20210338834-A1 DEGRADABLE HYALURONIC ACID HYDROGELS CD44, HPSE, MMP13 POLB 4429/4885ALDH1A1 101/4885SMN1; SMN2 4389/4885
US-20230330245-A1 ANTIBODY-EXATECAN CONJUGATES ERBB3, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, IL23R POLB 4236/4885ALDH1A1 2883/4885SMN1; SMN2 3230/4885
US-20210330798-A1 TREATMENT OF INFECTIONS H1-10, PM20D2, ELANE POLB 3078/4885ALDH1A1 1667/4885SMN1; SMN2 2076/4885

“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.