SCHEMBL3206853

SCHEMBL3206853

Cn1cnc(CCC(=O)ON)c1

nearest known ligand 0.54

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 1/20 0.54
TSHR P16473 1/20 0.54
CYP2C19 P33261 1/20 0.54
MTOR P42345 1/20 0.54
HRH4 Q9H3N8 1/20 0.54
HRH3 Q9Y5N1 1/20 0.54
TDP1 Q9NUW8 1/20 0.53
NAMPT P43490 2/20 0.34
HPGDS O60760 1/20 0.34
OPRM1 P35372 1/20 0.32
CPB2 Q96IY4 3/20 0.32
CPB1 P15086 2/20 0.32
PIK3CA P42336 1/20 0.31
PIK3CG P48736 1/20 0.31
ACACB O00763 1/20 0.30
FPR2 P25090 1/20 0.30
SCN9A Q15858 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
SCHEMBL3929706 0.85 TSHR (0.51) CYP2C9TSHRCYP2C19MTORHRH4
SCHEMBL6133025 0.83 CYP2C9 (0.49) CYP2C9TSHRCYP2C19MTORHRH4
SCHEMBL9953900 0.81 CYP2C9 (0.59) CYP2C9TSHRCYP2C19MTORHRH4
SCHEMBL10265735 0.80 CYP2C9 (0.46) CYP2C9TSHRCYP2C19MTORHRH4
Hydrochloric Acid SCHEMBL7422764 0.80 TDP1 (0.61) CYP2C9TSHRCYP2C19MTORHRH4
SCHEMBL13563913 0.80 TSHR (0.56) CYP2C9TSHRCYP2C19MTORHRH4
SCHEMBL2629331 0.80 CYP2C9 (0.56) CYP2C9TSHRCYP2C19MTORHRH4
Hydrochloric Acid SCHEMBL1310275 0.78 TDP1 (0.58) CYP2C9TSHRCYP2C19MTORHRH4
SCHEMBL14562252 0.78 CYP2C9 (0.44) CYP2C9TSHRCYP2C19MTORHRH4
SCHEMBL20750833 0.77 CYP2C9 (0.43) CYP2C9TSHRCYP2C19MTORHRH4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9779901-B2 High temperature material compositions for high temperature thermal cutoff devices THERM-O-DISC, INCORPORATED (US) 2017-10-03 US disclosed
US-20150162153-A1 HIGH TEMPERATURE MATERIAL COMPOSITIONS FOR HIGH TEMPERATURE THERMAL CUTOFF DEVICES THERM-O-DISC, INCORPORATED (US) 2015-06-11 US disclosed
US-8961832-B2 High temperature material compositions for high temperature thermal cutoff devices THERM-O-DISC, INCORPORATED (US) 2015-02-24 US disclosed
US-20120121795-A1 HIGH TEMPERATURE MATERIAL COMPOSITIONS FOR HIGH TEMPERATURE THERMAL CUTOFF DEVICES THERM-O-DISC, INCORPORATED (US) 2012-05-17 US disclosed
US-20100033295-A1 HIGH TEMPERATURE THERMAL CUTOFF DEVICE THERM-O-DISC, INCORPORATED (US) 2010-02-11 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-20120121795-A1 HIGH TEMPERATURE MATERIAL COMPOSITIONS FOR HIGH TEMPERATURE THERMAL CUTOFF DEVICES HTT, HTR1A, TPH1 CYP2C9 1341/4885TSHR 3602/4885CYP2C19 1336/4885

“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.