SCHEMBL708978

SCHEMBL708978

[NH]C(=O)CCSSCCC([NH])=O

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.56
LMNA P02545 4/20 0.43
KMT2A Q03164 1/20 0.38
HSD17B10 Q99714 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
FOLH1 Q04609 1/20 0.34
ALKBH5 Q6P6C2 1/20 0.33
SUCNR1 Q9BXA5 1/20 0.33
EGLN1 Q9GZT9 1/20 0.33
SLC22A6 Q4U2R8 1/20 0.30
CYP2C19 P33261 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
SCHEMBL11476145 0.77 LMNA (0.74) TSHRLMNAKMT2AHSD17B10TDP1
SCHEMBL2949601 0.75
SCHEMBL6706926 0.73
SCHEMBL95982 0.72 TSHR (1.00) TSHRLMNAKMT2AHSD17B10TDP1
Selenium SCHEMBL30845448 0.69 TSHR (0.93) TSHRLMNAKMT2AHSD17B10TDP1
SCHEMBL30845449 0.69 TSHR (0.93) TSHRLMNAKMT2AHSD17B10TDP1
Water SCHEMBL11221867 0.69 TSHR (0.93) TSHRLMNAKMT2AHSD17B10TDP1
SCHEMBL1498152 0.69
Ammonia Solution, Strong SCHEMBL8958644 0.69 TSHR (0.93) TSHRLMNAKMT2AHSD17B10TDP1
Hydrochloric Acid SCHEMBL10457214 0.69 TSHR (0.93) TSHRLMNAKMT2AHSD17B10TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8124757-B2 Thiol-modified macromolecule derivatives and cross-linked materials thereof BIOREGEN BIOMEDICAL (CHANGZHOU) CO., LTD. (CN) 2012-02-28 US disclosed
US-20100152423-A1 THIOL-MODIFIED MACROMOLECULE DERIVATIVES AND CROSS-LINKED MATERIALS THEREOF BIOREGEN BIOMEDICAL (CHANGZHOU) CO., LTD. (CN) 2010-06-17 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-20100152423-A1 THIOL-MODIFIED MACROMOLECULE DERIVATIVES AND CROSS-LINKED MATERIALS THEREOF PTMS, TMT1A, EPCAM TSHR 863/4885LMNA 3917/4885KMT2A 1418/4885

“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.