Zinc Ion

Zinc Ion

SCHEMBL6913362

NCCC(=O)NCCS(=O)(=O)[O-].NCCC(=O)NCCS(=O)(=O)[O-].[Zn+2]

nearest known ligand 0.41

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.41
LMNA P02545 3/20 0.39
TSHR P16473 2/20 0.39
ALDH1A1 P00352 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
GMNN O75496 1/20 0.39
TP53 P04637 1/20 0.39
MAPK1 P28482 1/20 0.39
THPO P40225 1/20 0.39
HBB P68871 1/20 0.39
PMP22 Q01453 1/20 0.39
CA1 P00915 4/20 0.38
CA2 P00918 4/20 0.38
CYP3A4 P08684 1/20 0.37
CYP2D6 P10635 1/20 0.37
CYP2C19 P33261 1/20 0.37
CA9 Q16790 3/20 0.37
CA12 O43570 1/20 0.37
MMP2 P08253 1/20 0.36
BBOX1 O75936 1/20 0.35

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
SCHEMBL4183162 0.80 LMNA (0.46) L3MBTL1LMNATSHRSMN1; SMN2CA1
SCHEMBL3897867 0.79 CA9 (0.39) L3MBTL1LMNATSHRALDH1A1SMN1; SMN2
SCHEMBL6913359 0.78 LMNA (0.44) L3MBTL1LMNATSHRSMN1; SMN2CA1
SCHEMBL4760493 0.74
SCHEMBL8618817 0.72 BBOX1 (0.38) L3MBTL1LMNATSHRALDH1A1SMN1; SMN2
Sulfuric Acid SCHEMBL6912106 0.72 NAAA (0.41) LMNATSHRALDH1A1SMN1; SMN2CYP3A4
SCHEMBL9082257 0.72 BBOX1 (0.38) L3MBTL1LMNATSHRALDH1A1SMN1; SMN2
SCHEMBL12829898 0.72 CASP2 (0.46) L3MBTL1LMNATSHRALDH1A1SMN1; SMN2
SCHEMBL7204674 0.72 CASP2 (0.52) L3MBTL1LMNATSHRALDH1A1SMN1; SMN2
SCHEMBL688115 0.72 FAAH (0.57) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6762174-B1 BETA-ALETHINE WITH MELPHALAN OR CYCLOPHOSPHAMIDE; PREVENTS CLINICAL APPEARANCE OF A NEOPLASTIC OR PRE-NEOPLASTIC CONDITION; IMMUNOMODULATION; ENHANCING CELL GROWTH, VITALITY, DIFFERENTIATION; ANTISENESCENCE DOVETAIL TECHNOLOGIES, INC. 2004-07-13 US disclosed
US-6498150-B2 USEFUL IN ENHANCING VACCINATION, INCREASING SYNTHESIS AND FUNCTION OF BLOOD CELL COMPONENTS, AND ENHANCING ANTITUMOR EFFECTS DOVETAIL TECHNOLOGIES, INC. 2002-12-24 US disclosed
US-6451853-B1 Small molecules that elicit a polarized Th1 response and for modulation of cellular immunity DOVETAIL TECHNOLOGIES, INC 2002-09-17 US disclosed
US-20020035118-A1 LOW MOLECULAR WEIGHT CELL, BONE MARROW AND IMMUNE STIMULANTS DOVETAIL TECHNOLOGIES INC. 2002-03-21 US disclosed
US-6007819-A Methods of inducing immunity using low molecular weight immune stimulants DOVETAIL TECHNOLOGIES, INC. (US) 1999-12-28 US disclosed
WO-1999042099-A1 LOW MOLECULAR WEIGHT COMPOUNDS ADMINISTERED TOGETHER WITH ANTI-CANCER AGENTS TO TREAT CANCER AND PHARMACEUTICAL COMPOSITIONS THEREOF DOVETAIL TECHNOLOGIES INC. (US) 1999-08-26 WO disclosed
WO-1999042097-A1 SMALL MOLECULES THAT ELICIT A POLARIZED TH1 RESPONSE AND FOR MODULATION OF CELLULAR IMMUNITY DOVETAIL TECHNOLOGIES INC. (US) 1999-08-26 WO disclosed
WO-1997014306-A1 LOW MOLECULAR WEIGHT CELL, BONE MARROW AND IMMUNE STIMULANTS DOVETAIL TECHNOLOGIES, INC. (US) 1997-04-24 WO 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-20020035118-A1 LOW MOLECULAR WEIGHT CELL, BONE MARROW AND IMMUNE STIMULANTS ACP1, CD14, HPGDS L3MBTL1 4021/4885LMNA 3542/4885TSHR 4615/4885

“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.