SCHEMBL3510033

SCHEMBL3510033

C=CCSSc1ccccn1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EHMT2 Q96KQ7 1/20 0.57
EHMT1 Q9H9B1 1/20 0.57
APOBEC3G Q9HC16 1/20 0.57
L3MBTL1 Q9Y468 3/20 0.45
NPC1 O15118 2/20 0.45
RAB9A P51151 2/20 0.45
TDP1 Q9NUW8 1/20 0.45
TSHR P16473 1/20 0.43
ALDH1A1 P00352 6/20 0.38
LMNA P02545 1/20 0.37
HPGD P15428 2/20 0.36
ALOX15 P16050 2/20 0.36
KDM4E B2RXH2 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
HSD17B10 Q99714 1/20 0.36
KMT2A Q03164 3/20 0.36
MEN1 O00255 2/20 0.36
TRPA1 O75762 1/20 0.36
CYP3A4 P08684 1/20 0.36
MAPT P10636 2/20 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
Phthalimide SCHEMBL28729831 0.85 EHMT2 (0.42) EHMT2EHMT1APOBEC3GL3MBTL1NPC1
SCHEMBL3647399 0.85 NPC1 (0.61) EHMT2EHMT1APOBEC3GL3MBTL1NPC1
SCHEMBL2874801 0.85 NPC1 (0.61) EHMT2EHMT1APOBEC3GL3MBTL1NPC1
Hydrogen Sulfide SCHEMBL27801563 0.83 NPC1 (0.59) EHMT2EHMT1APOBEC3GL3MBTL1NPC1
SCHEMBL13882921 0.82 EHMT2 (0.53) EHMT2EHMT1APOBEC3GL3MBTL1NPC1
SCHEMBL9846637 0.79 EHMT2 (0.64) EHMT2EHMT1APOBEC3GL3MBTL1NPC1
SCHEMBL11036195 0.79 EHMT2 (0.64) EHMT2EHMT1APOBEC3GL3MBTL1NPC1
SCHEMBL10051085 0.78 EHMT2 (0.48) EHMT2EHMT1APOBEC3GL3MBTL1NPC1
SCHEMBL11833495 0.78 EHMT2 (0.70) EHMT2EHMT1APOBEC3GL3MBTL1NPC1
SCHEMBL2618715 0.78 EHMT2 (0.77) EHMT2EHMT1APOBEC3GL3MBTL1NPC1

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
CN-110256485-A A kind of phosphatide cpd and preparation method thereof 东南大学 2019-09-20 CN claimed
CN-110256485-A A kind of phosphatide cpd and preparation method thereof 东南大学 2019-09-20 CN disclosed
CN-110256485-A A kind of phosphatide cpd and preparation method thereof 东南大学 2019-09-20 CN disclosed
US-20100222546-A1 METHODS FOR THE PREPARATION OF FUNCTIONALIZED PEPTIDES, PROTEINS AND CARBOHYDRATES AND THEIR CONJUGATES NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2010-09-02 US disclosed
WO-2008066816-A2 DERIVATIZATION OR LIGATON OF PEPTIDES THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2008-06-05 WO disclosed
EP-1259524-A2 NUCLEOTIDES AND POLYNUCLEOTIDES IMMOBILISED ON A SOLID SUPPORT VIA A DISULPHIDE LINKAGE Amersham Biosciences UK Limited (GB) 2002-11-27 EP disclosed
WO-2000053616-A2 NUCLEOTIDES AND POLYNUCLEOTIDES IMMOBILISED ON A SOLID SUPPORT VIA A DISULPHIDE LINKAGE AMERSHAM PHARMACIA BIOTECH UK LTD (GB) 2000-09-14 WO disclosed
US-4053606-A ANTIINFLAMMATORY AND ANTIARTHRITIC AGENTS MERCK & CO., INC. (US) 1977-10-11 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 (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-20100222546-A1 METHODS FOR THE PREPARATION OF FUNCTIONALIZED PEPTIDES, PROTEINS AND CARBOHYDRATES AND THEIR CONJUGATES PTMS, STT3A, GCG EHMT2 3464/4885EHMT1 3533/4885APOBEC3G 1056/4885

“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.