SCHEMBL21180035

SCHEMBL21180035

CCCCCCCC(C)(CCCCCC)OO

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GGPS1 O95749 6/20 0.41
SMPD1 P17405 5/20 0.41
FDPS P14324 9/20 0.40
TSHR P16473 1/20 0.40
THRB P10828 1/20 0.40
CES2 O00748 1/20 0.39
LPAR1 Q92633 1/20 0.39
LPAR3 Q9UBY5 1/20 0.39

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
SCHEMBL8026010 0.90 TSHR (0.36) GGPS1SMPD1FDPSTSHRTHRB
SCHEMBL14224343 0.85 TSHR (0.33) FDPSTSHR
SCHEMBL24496713 0.81 GGPS1 (0.39) GGPS1SMPD1FDPSTSHRTHRB
SCHEMBL24496681 0.81 GGPS1 (0.39) GGPS1SMPD1FDPSTSHRTHRB
SCHEMBL24496700 0.81 GGPS1 (0.39) GGPS1SMPD1FDPSTSHRTHRB
SCHEMBL3628284 0.80 TSHR (0.44) GGPS1SMPD1FDPSTSHRTHRB
SCHEMBL11514263 0.80 TSHR (0.39) FDPSTSHR
SCHEMBL8740256 0.80 GGPS1 (0.41) GGPS1SMPD1FDPSTSHRTHRB
SCHEMBL3574443 0.80 GGPS1 (0.41) GGPS1SMPD1FDPSTSHRTHRB
SCHEMBL8062566 0.79 TSHR (0.44) GGPS1SMPD1FDPSTSHRTHRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10361381-B2 Organic electroluminescent materials and devices UNIVERSAL DISPLAY CORPORATION (US) 2019-07-23 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-10361381-B2 Organic electroluminescent materials and devices NR1D2, NR1D1, NR1H2 GGPS1 72/4885SMPD1 4443/4885FDPS 1798/4885

“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.