SCHEMBL4945280

SCHEMBL4945280

CCCC(CCC)OC(C)O

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.38
HSD17B10 Q99714 1/20 0.33
LMNA P02545 1/20 0.32
CHRM1 P11229 1/20 0.31
AKR1A1 P14550 1/20 0.31
CHRM3 P20309 1/20 0.31
HTR2A P28223 1/20 0.31
HTR2C P28335 1/20 0.31
ADRA1A P35348 1/20 0.31
HRH1 P35367 1/20 0.31
DRD3 P35462 1/20 0.31
SLC6A3 Q01959 1/20 0.31
HDAC1 Q13547 1/20 0.31
HDAC2 Q92769 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
SPHK1 Q9NYA1 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
SCHEMBL19215716 0.90 TSHR (0.38) TSHRHSD17B10LMNA
SCHEMBL4942699 0.90 TSHR (0.38) TSHRHSD17B10LMNA
SCHEMBL28752174 0.87 SPHK1 (0.45) LMNASPHK1
SCHEMBL430876 0.78 TSHR (0.33) TSHRCHRM1AKR1A1CHRM3HTR2A
SCHEMBL2167547 0.78
SCHEMBL4440508 0.78
SCHEMBL4945754 0.77
Ammonia Solution, Strong SCHEMBL241739 0.76 TSHR (0.32) TSHRCHRM1AKR1A1CHRM3HTR2A
SCHEMBL10783170 0.74 CTSK (0.48) SLC6A3HDAC1HDAC2
Ethylene Glycol SCHEMBL22581580 0.74 TSHR (0.39) TSHRHSD17B10LMNACHRM1AKR1A1

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
EP-1939165-B1 POLYVINYL ETHER COMPOUND IDEMITSU KOSAN CO (JP) 2012-06-13 EP disclosed
EP-1939165-A1 POLYVINYL ETHER COMPOUND IDEMITSU KOSAN CO., LTD. (JP) 2008-07-02 EP disclosed
US-20080108850-A1 Addition-condensation copolymers containing polyoxyethylene glycol; high viscosity; used as lubricating oil for compression refrigerator IDEMITSU KOSAN CO., LTD. (JP) 2008-05-08 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-20080108850-A1 Addition-condensation copolymers containing polyoxyethylene glycol; high viscosity; used as lubricating oil for compression refrigerator CENPE, INCENP, CETP TSHR 4803/4885HSD17B10 896/4885LMNA 114/4885

“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.