SCHEMBL13855529

SCHEMBL13855529

O=C(O)CCCCCCCCCCSSCCCCCCCCCCSSCCCCCCCCCCC(=O)O

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 6/20 0.67
LMNA P02545 3/20 0.67
NFKB1 P19838 1/20 0.67
PMP22 Q01453 1/20 0.67
GPR84 Q9NQS5 8/20 0.55
FFAR1 O14842 2/20 0.55
FFAR4 Q5NUL3 2/20 0.55
SLC22A6 Q4U2R8 2/20 0.53
PPARG P37231 6/20 0.52
PPARD Q03181 6/20 0.52
PPARA Q07869 6/20 0.52
HDAC11 Q96DB2 5/20 0.52
ALDH1A1 P00352 3/20 0.52
TLR2 O60603 2/20 0.52
TDP1 Q9NUW8 2/20 0.52
MEN1 O00255 2/20 0.52
FABP4 P15090 2/20 0.52
ALOX15 P16050 2/20 0.52
PTPN1 P18031 2/20 0.52
KMT2A Q03164 2/20 0.52

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
SCHEMBL7686798 1.00 TSHR (0.67) TSHRLMNANFKB1PMP22GPR84
SCHEMBL1163681 1.00 TSHR (0.67) TSHRLMNANFKB1PMP22GPR84
SCHEMBL7689233 1.00 TSHR (0.67) TSHRLMNANFKB1PMP22GPR84
SCHEMBL28887669 1.00 TSHR (0.67) TSHRLMNANFKB1PMP22GPR84
SCHEMBL7687851 1.00 TSHR (0.67) TSHRLMNANFKB1PMP22GPR84
SCHEMBL1673083 1.00 TSHR (0.67) TSHRLMNANFKB1PMP22GPR84
SCHEMBL6828156 1.00 TSHR (0.67) TSHRLMNANFKB1PMP22GPR84
SCHEMBL931298 1.00 TSHR (0.67) TSHRLMNANFKB1PMP22GPR84
SCHEMBL1163365 1.00 TSHR (0.67) TSHRLMNANFKB1PMP22GPR84
SCHEMBL4282712 1.00 TSHR (0.67) TSHRLMNANFKB1PMP22GPR84

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-8647613-B2 Drug carrier JCR PHARMACEUTICALS CO., LTD. (JP) 2014-02-11 US disclosed
US-20090136443-A1 Drug Carrier OXGENIX CO., LTD. (JP) 2009-05-28 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 (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-20090136443-A1 Drug Carrier ABCB11, SLC47A1, SLC47A2 TSHR 1837/4885LMNA 2383/4885NFKB1 2594/4885

“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.