SCHEMBL1018876

SCHEMBL1018876

[CH2]C(CC)(CC)CCCCCCCC

nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.44
THRB P10828 1/20 0.44
GGPS1 O95749 6/20 0.39
FDPS P14324 9/20 0.38
SMPD1 P17405 2/20 0.37
CES2 O00748 1/20 0.37
LPAR1 Q92633 1/20 0.37
LPAR3 Q9UBY5 1/20 0.37

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
SCHEMBL8670374 1.00 TSHR (0.44) TSHRTHRBGGPS1FDPSSMPD1
SCHEMBL29064055 1.00 TSHR (0.44) TSHRTHRBGGPS1FDPSSMPD1
SCHEMBL22449292 0.94 TSHR (0.44) TSHRTHRBGGPS1FDPSSMPD1
SCHEMBL10535683 0.92 TSHR (0.39) TSHRTHRBGGPS1FDPSSMPD1
SCHEMBL7253883 0.88 TSHR (0.50) TSHRTHRBGGPS1FDPSSMPD1
SCHEMBL8716134 0.88 TSHR (0.50) TSHRTHRBGGPS1FDPSSMPD1
SCHEMBL60278 0.88 TSHR (0.35) TSHRTHRBFDPS
SCHEMBL28857305 0.88 TSHR (0.50) TSHRTHRBGGPS1FDPSSMPD1
SCHEMBL28085782 0.88 TSHR (0.50) TSHRTHRBGGPS1FDPSSMPD1
SCHEMBL9808555 0.88 TSHR (0.50) TSHRTHRBGGPS1FDPSSMPD1

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 23 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2314583-B1 NITROGENATED HETEROCYCLIC DERIVATIVE, AND AGRICULTURAL OR HORTICULTURAL BACTERICIDAL AGENT NIPPON SODA CO (JP) 2015-02-25 EP disclosed
US-8557738-B2 Nitrogen-containing heterocyclic derivative and fungicide for agricultural and horticultural use NIPPON SODA CO., LTD. (JP) 2013-10-15 US disclosed
CN-101747350-B Thiazolothiazole derivative FUJI XEROX CO LTD 2013-04-03 CN disclosed
US-8263972-B2 Organic electroluminescent device and display medium FUJI XEROX CO. LTD. (JP) 2012-09-11 US disclosed
US-8217391-B2 Organic semiconductor transistor, method of producing the same, and electronic device FUJI XEROX CO., LTD. (JP) 2012-07-10 US disclosed
US-20110136782-A1 NITROGEN-CONTAINING HETEROCYCLIC DERIVATIVE AND FUNGICIDE FOR AGRICULTURAL AND HORTICULTURAL USE NIPPON SODA CO., LTD (JP) 2011-06-09 US disclosed
EP-2314583-A1 NITROGENATED HETEROCYCLIC DERIVATIVE, AND AGRICULTURAL OR HORTICULTURAL BACTERICIDAL AGENT Nippon Soda Co., Ltd. (JP) 2011-04-27 EP disclosed
EP-2280009-A1 NITROGENOUS HETEROCYCLIC COMPOUNDS AND FUNGICIDES FOR AGRICULTURAL AND HORTICULTURAL USE Nippon Soda Co., Ltd. (JP) 2011-02-02 EP disclosed
EP-2233488-B1 THIAZOLOTHIAZOLE DERIVATIVES AND ORGANIC ELECTRONIC DEVICE USING THE SAME FUJI XEROX CO LTD (JP) 2011-01-12 EP disclosed
US-20100276672-A1 ORGANIC ELECTROLUMINESCENT DEVICE AND DISPLAY MEDIUM FUJI XEROX CO., LTD. (JP) 2010-11-04 US disclosed
CN-101747350-A thiazolothiazole derivative FUJI XEROX CO LTD 2010-06-23 CN disclosed
US-20100137611-A1 THIAZOLOTHIAZOLE DERIVATIVE FUJI XEROX CO., LTD. (JP) 2010-06-03 US disclosed
US-4249531-A SUSTAINED RELEASE FROM A HYDROPHOBIC ACRYLIC POLYMER HAVING IONIZABLE CARBOXYLIC ACID GROUPS ALZA CORPORATION (US) 1981-02-10 US disclosed
US-4180064-A HYDROPHOBIC POLYMERS WITH CARBOXYLIC ACID GROUPS ALZA CORPORATION (US) 1979-12-25 US disclosed
US-4142526-A Osmotic releasing system with means for changing release therefrom ALZA CORPORATION (US) 1979-03-06 US disclosed
US-4135514-A Osmotic releasing system for administering ophthalmic drug to eye of animal ALZA CORPORATION (US) 1979-01-23 US disclosed
US-4096238-A Method for administering drug to the gastrointestinal tract ALZA CORPORATION (US) 1978-06-20 US disclosed
US-4093708-A ADMINISTERING AN OPHTHAMALIC DRUG TO THE TEAR FLUID OF THE EYE, BIOEROSION ALZA CORPORATION (US) 1978-06-06 US disclosed
US-4036227-A Osmotic releasing device having a plurality of release rate patterns ALZA CORPORATION (US) 1977-07-19 US disclosed
US-4014987-A VAGINAL DEVICE; USING A HYDROPHOBIC POLYCARBOXYLIC ACID AS DRUG RELEASE RATE CONTROLLER ALZA CORPORATION (US) 1977-03-29 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 (3 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-20100276672-A1 ORGANIC ELECTROLUMINESCENT DEVICE AND DISPLAY MEDIUM L1CAM, OR10J3, ALK TSHR 1934/4885THRB 1437/4885GGPS1 2873/4885
US-20100137611-A1 THIAZOLOTHIAZOLE DERIVATIVE BCAT1, ABAT, BCAT2 TSHR 342/4885THRB 335/4885GGPS1 3029/4885
US-20110136782-A1 NITROGEN-CONTAINING HETEROCYCLIC DERIVATIVE AND FUNGICIDE FOR AGRICULTURAL AND HORTICULTURAL USE CBR3, NOS1, CBR1 TSHR 1639/4885THRB 2830/4885GGPS1 4578/4885

“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.