SCHEMBL3116338

SCHEMBL3116338

CCCCCC([CH]C(CC)CCCC)CC

nearest known ligand 0.58

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.58
SMN1; SMN2 Q16637 1/20 0.58
DNM1 Q05193 2/20 0.42
OPRM1 P35372 1/20 0.40
ALDH1A1 P00352 3/20 0.37
TDP1 Q9NUW8 1/20 0.37
LMNA P02545 1/20 0.37
CYP3A4 P08684 1/20 0.36
CA2 P00918 2/20 0.35
ADH1B P00325 1/20 0.35
ADH1C P00326 1/20 0.35
ADH1A P07327 1/20 0.35
ADH4 P08319 1/20 0.35
ADH7 P40394 1/20 0.35
THRB P10828 1/20 0.35
FDPS P14324 1/20 0.34
MAPK1 P28482 1/20 0.34

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
SCHEMBL4270725 0.97 TSHR (0.56) TSHRSMN1; SMN2DNM1OPRM1ALDH1A1
SCHEMBL4271560 0.97 TSHR (0.56) TSHRSMN1; SMN2DNM1OPRM1LMNA
SCHEMBL4269438 0.97 TSHR (0.56) TSHRSMN1; SMN2DNM1OPRM1ALDH1A1
SCHEMBL4269740 0.97 TSHR (0.56) TSHRSMN1; SMN2DNM1OPRM1ALDH1A1
SCHEMBL4277902 0.97 TSHR (0.56) TSHRSMN1; SMN2DNM1OPRM1LMNA
SCHEMBL4270137 0.97 TSHR (0.56) TSHRSMN1; SMN2DNM1OPRM1LMNA
SCHEMBL4274210 0.97 TSHR (0.54) TSHRSMN1; SMN2DNM1OPRM1LMNA
SCHEMBL4274184 0.95 TSHR (0.54) TSHRSMN1; SMN2DNM1OPRM1LMNA
SCHEMBL4277457 0.95 TSHR (0.54) TSHRSMN1; SMN2DNM1OPRM1LMNA
SCHEMBL4279208 0.95 TSHR (0.54) TSHRSMN1; SMN2DNM1OPRM1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10230023-B2 Color converter BASF SE (DE) 2019-03-12 US disclosed
EP-2718395-B1 Novel illumination device comprising a colour converter BASF SE (DE) 2018-02-28 EP disclosed
US-20160284947-A1 NOVEL COLOR CONVERTER BASF SE (DE) 2016-09-29 US disclosed
US-9406848-B2 Color converter BASF SE (DE) 2016-08-02 US disclosed
EP-2718395-A1 NOVEL COLOR CONVERTER BASF SE (DE) 2014-04-16 EP disclosed
WO-2012168395-A1 NOVEL COLOR CONVERTER BASF SE (DE) 2012-12-13 WO disclosed
EP-2280965-B1 THIAZOL-4-CARBOXYLIC ACID ESTERS AND THIOESTERS AS PLANT PROTECTION AGENTS BAYER CROPSCIENCE AG (DE) 2012-08-29 EP disclosed
EP-2198710-A1 Use of 5-pyridin-4yl-(1,3) thiazoles for combating phytopathogenic fungi Bayer CropScience AG (DE) 2010-06-23 EP disclosed
EP-2161259-A1 4-Haloalkyl substituted Diaminopyrimidine Bayer CropScience AG (DE) 2010-03-10 EP disclosed
WO-2009037283-A1 METHOD FOR PRODUCING SUBSTRATES COATED WITH RYLENE TETRACARBOLIC ACID DIIMIDES BASF SE (DE) 2009-03-26 WO disclosed
US-20090078312-A1 VERFAHREN ZUR HERSTELLUNG VON MIT RYLENTETRACARBONSAEUREDIIMIDEN BESCHICHTETEN SUBSTRATEN BASF SE (DE) 2009-03-26 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-20090078312-A1 VERFAHREN ZUR HERSTELLUNG VON MIT RYLENTETRACARBONSAEUREDIIMIDEN BESCHICHTETEN SUBSTRATEN AXIN2, NCSTN, NES TSHR 3585/4885SMN1; SMN2 3380/4885DNM1 1249/4885

“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.