SCHEMBL387572

SCHEMBL387572

[CH]=CC(CC)CCCCC

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
OPRM1 P35372 1/20 0.39
LMNA P02545 1/20 0.36
DNM1 Q05193 2/20 0.35
ADH1B P00325 1/20 0.34
ADH1C P00326 1/20 0.34
ADH1A P07327 1/20 0.34
ADH4 P08319 1/20 0.34
ADH7 P40394 1/20 0.34
FDPS P14324 4/20 0.33
THRB P10828 1/20 0.33
TRPA1 O75762 1/20 0.33
DDAH1 O94760 1/20 0.33
GAPDH P04406 1/20 0.33
MAPT P10636 1/20 0.33
GPR84 Q9NQS5 2/20 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
SCHEMBL28618097 0.98 TSHR (0.48) TSHRSMN1; SMN2OPRM1LMNADNM1
SCHEMBL28608681 0.98 TSHR (0.48) TSHRSMN1; SMN2OPRM1LMNADNM1
SCHEMBL26089412 0.92
SCHEMBL8606116 0.81
SCHEMBL15170448 0.80 TSHR (0.50) TSHRSMN1; SMN2OPRM1LMNADNM1
SCHEMBL4274210 0.79 TSHR (0.54) TSHRSMN1; SMN2OPRM1LMNADNM1
SCHEMBL9208137 0.78 TSHR (0.48) TSHRSMN1; SMN2OPRM1LMNADNM1
SCHEMBL4267303 0.78 TSHR (0.48) TSHRSMN1; SMN2OPRM1LMNADNM1
SCHEMBL10600803 0.78 TSHR (0.48) TSHRSMN1; SMN2OPRM1LMNADNM1
SCHEMBL27732481 0.78 TSHR (0.48) TSHRSMN1; SMN2OPRM1LMNADNM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118139926-A Resin composition 株式会社可乐丽 2024-06-04 CN disclosed
CN-118139909-A Beta-methyl-delta-valerolactone based polymer 株式会社可乐丽 2024-06-04 CN disclosed
CN-112771046-B Other substituted triazoloquinoxaline derivatives 格吕伦塔尔有限公司 2023-09-19 CN disclosed
CN-112673009-B Substituted triazoloquinoxaline derivatives 格吕伦塔尔有限公司 2023-09-19 CN disclosed
WO-2023068346-A1 Β-METHYL-δ-VALEROLACTONE POLYMER 株式会社クラレ 2023-04-27 WO disclosed
WO-2023068345-A1 Β-METHYL-δ-VALEROLACTONE POLYMER 株式会社クラレ 2023-04-27 WO disclosed
WO-2023068348-A1 RESIN COMPOSITION 株式会社クラレ 2023-04-27 WO disclosed
US-8101650-B2 Method for treating a immunology-related disease DAIICHI SANKYO COMPANY, LIMITED (JP) 2012-01-24 US disclosed
US-8067396-B2 Amino alcohol compounds or phosphonic acid derivatives thereof SANKYO COMPANY, LIMITED (JP) 2011-11-29 US disclosed
US-20100035842-A1 Amino alcohol compounds or phosphonic acid derivatives thereof SANKYO COMPANY, LIMITED (JP) 2010-02-11 US disclosed
EP-1471054-A1 AMINO ALCOHOL DERIVATIVE OR PHOSPHONIC ACID DERIVATIVE AND MEDICINAL COMPOSITION CONTAINING THESE Sankyo Company, Limited (JP) 2004-10-27 EP disclosed
US-20040132784-A1 Amino alcohol derivatives SANKYO COMPANY, LIMITED (JP) 2004-07-08 US disclosed
CN-1494540-A Amino alcohol derivatives ������������ʽ���� 2004-05-05 CN disclosed
US-6723745-B2 PREVENTION OR TREATMENT OF AUTOIMMUNE DISEASE IN WARM BLOODED ANIMAL SANKYO COMPANY, LIMITED (JP) 2004-04-20 US disclosed
US-20030236297-A1 Amino alcohol derivatives SANKYO COMPANY, LIMITED (JP) 2003-12-25 US disclosed
EP-1300405-A1 AMINO ALCOHOL DERIVATIVES Sankyo Company, Limited (JP) 2003-04-09 EP disclosed
US-6231934-B1 Alkenyl compound, liquid crystal composition, and liquid crystal display device CHISSO CORPORATION (JP) 2001-05-15 US disclosed
US-6124005-A EXCELLENT COMPATIBILITY WITH OTHER LIQUID CRYSTAL MATERIALS, ESPECIALLY AT LOW TEMPERATURES, HIGH VOLTAGE HOLDING RATIO, LOW THRESHOLD VOLTAGE, SMALL TEMPERATURE DEPENDENCY, BROAD LIQUID PHASE TEMPERATURE RANGE CHISSO CORPORATION (JP) 2000-09-26 US disclosed
EP-0926120-A1 FLUORINATED ALKYL ETHER COMPOUNDS, LIQUID-CRYSTAL COMPOSITIONS, AND LIQUID-CRYSTAL DISPLAY DEVICES CHISSO CORPORATION (JP) 1999-06-30 EP disclosed
EP-0893421-A1 ALKENYL COMPOUNDS, LIQUID CRYSTAL COMPOSITIONS, AND LIQUID CRYSTAL DISPLAY DEVICES CHISSO CORPORATION (JP) 1999-01-27 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 (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-20030236297-A1 Amino alcohol derivatives CD4, ADH1C, ADH1A TSHR 1187/4885SMN1; SMN2 4220/4885OPRM1 163/4885
US-20040132784-A1 Amino alcohol derivatives CD4, ADH1C, ADH1A TSHR 1187/4885SMN1; SMN2 4220/4885OPRM1 163/4885
US-20100035842-A1 Amino alcohol compounds or phosphonic acid derivatives thereof PHOSPHO1, ADH1C, ADH1A TSHR 744/4885SMN1; SMN2 4797/4885OPRM1 753/4885

“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.