SCHEMBL3095058

SCHEMBL3095058

CC(CS)C(=O)OC1(OC(=O)C(C)CS)CCCCC1

nearest known ligand 0.37

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MME P08473 1/20 0.37
ACE P12821 3/20 0.32
KDM4E B2RXH2 1/20 0.32
F2 P00734 1/20 0.32
REN P00797 1/20 0.32
LMNA P02545 1/20 0.32
LTA4H P09960 1/20 0.32
MAPT P10636 1/20 0.32
PEPD P12955 1/20 0.32
ALOX15 P16050 1/20 0.32
PTGS1 P23219 1/20 0.32
HTR2A P28223 1/20 0.32
PTGS2 P35354 1/20 0.32
HRH1 P35367 1/20 0.32
THPO P40225 1/20 0.32
PMP22 Q01453 1/20 0.32
HSD17B10 Q99714 1/20 0.32
ACE2 Q9BYF1 1/20 0.32

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
SCHEMBL7394275 0.91 MME (0.32) MME
SCHEMBL3089572 0.79
SCHEMBL9242870 0.77 MME (0.35) MME
SCHEMBL3091222 0.76 MME (0.36) MMEACEKDM4EF2REN
SCHEMBL3100768 0.74
SCHEMBL786032 0.74 ALDH1A1 (0.31) LMNAHTR2AHRH1THPOHSD17B10
SCHEMBL3089590 0.70 CYP2C19 (0.35) MME
SCHEMBL20872232 0.70 CYP3A4 (0.32) MME
SCHEMBL20872281 0.69 ACE (0.32) ACE
SCHEMBL7704470 0.68 ENPEP (0.38)

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
US-8283095-B2 Thiourethane compound and photosensitive resin composition SHOWA DENKO K.K. (JP) 2012-10-09 US disclosed
US-20100233596-A1 THIOURETHANE COMPOUND AND PHOTOSENSITIVE RESIN COMPOSITION SHOWA DENKO K.K. (JP) 2010-09-16 US disclosed
EP-2055726-A1 THIOURETHANE COMPOUND AND PHOTOSENSITIVE RESIN COMPOSITION Showa Denko K.K. (JP) 2009-05-06 EP 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-20100233596-A1 THIOURETHANE COMPOUND AND PHOTOSENSITIVE RESIN COMPOSITION RCOR3, CBR3, TAS2R3 MME 4643/4885ACE 4708/4885KDM4E 623/4885

“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.