SCHEMBL5605555

SCHEMBL5605555

C=CCC(C)C(CC)CCCC

nearest known ligand 0.36

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.36
ALDH1A1 P00352 5/20 0.36
SMN1; SMN2 Q16637 1/20 0.34
TDP1 Q9NUW8 1/20 0.31
CYP3A4 P08684 1/20 0.30
DNM1 Q05193 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
SCHEMBL4303707 0.92 TSHR (0.40) TSHRALDH1A1DNM1
SCHEMBL9075468 0.87 MMP9 (0.33) TSHR
SCHEMBL17030426 0.82 TSHR (0.32) TSHRALDH1A1
SCHEMBL9111527 0.82 ALDH1A1 (0.39) TSHRALDH1A1SMN1; SMN2TDP1CYP3A4
SCHEMBL9445647 0.80 TSHR (0.40) TSHRALDH1A1DNM1
SCHEMBL11659142 0.78 TSHR (0.39) TSHRALDH1A1SMN1; SMN2DNM1
SCHEMBL11817761 0.76 ALDH1A1 (0.46) TSHRALDH1A1SMN1; SMN2TDP1CYP3A4
SCHEMBL5673345 0.76 TSHR (0.34) TSHRALDH1A1SMN1; SMN2CYP3A4
SCHEMBL17607505 0.76 ALDH1A1 (0.34) TSHRALDH1A1SMN1; SMN2TDP1CYP3A4
SCHEMBL21608634 0.75 TSHR (0.36) TSHRALDH1A1SMN1; SMN2DNM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7256317-B2 subjecting olefin mixture to metathesis, separating olefins, dimerizing, derivatizing (via hydroformylation) after fractionation, then alkoxylating; BASF AKTIENGESELLSCHAFT (DE) 2007-08-14 US disclosed
US-7074749-B2 Oxoalcohol-based detergent BASF AKTIENGESELLSCHAFT (DE) 2006-07-11 US disclosed
EP-1294837-B1 OXOALCOHOL-BASED DETERGENT BASF AG (DE) 2005-08-24 EP disclosed
CN-1192085-C Oxoalcohol-based detergent BASF AG (DE) 2005-03-09 CN disclosed
US-20040186325-A1 subjecting olefin mixture to metathesis, separating olefins, dimerizing, derivatizing (via hydroformylation) after fractionation, then alkoxylating; BASF AKTIENGESELLSCHAFT (DE) 2004-09-23 US disclosed
CN-1159270-C Method for producing surfactant alcohols and surfactant alcohol ethers, resulting products and their use �����ɷ� 2004-07-28 CN disclosed
US-6737553-B1 SUBJECTING A C4-OLEFIN MIXTURE TO METATHESIS, DIMERIZING, DERIVATIZING BASF AKTIENGESELLSCHAFT (DE) 2004-05-18 US disclosed
EP-1140741-B1 METHOD FOR PRODUCING SURFACTANT ALCOHOLS AND SURFACTANT ALCOHOL ETHERS, THE RESULTING PRODUCTS AND THEIR USE BASF AG (DE) 2004-03-31 EP disclosed
CN-1484626-A Method for the production of alkyl aryl sulphonates 巴斯福股份公司 2004-03-24 CN disclosed
US-20040030209-A1 Catalytic alkylation using zeolite; sulfonation; neutralization BASF AKTIENGESELLSCHAFT (DE) 2004-02-12 US disclosed
US-20040009889-A1 Detergents and cleaners comprising nonionic and/or cationic surfactants based on oxo alcohols BASF AKTIENGESELLSCHAFT (DE) 2004-01-15 US disclosed
CN-1436228-A Oxoalcohol-based detergent BASF AG (DE) 2003-08-13 CN disclosed
EP-1294837-A1 OXOALCOHOL-BASED DETERGENT BASF AKTIENGESELLSCHAFT (DE) 2003-03-26 EP disclosed
CN-1331664-A Process for the preparation of surface-active alcohols and surface-active alcohol ethers, products prepared and their use BASF AG (DE) 2002-01-16 CN disclosed
WO-2001096508-A1 OXOALCOHOL-BASED DETERGENT BASF AKTIENGESELLSCHAFT (DE) 2001-12-20 WO disclosed
EP-1140741-A1 METHOD FOR PRODUCING SURFACTANT ALCOHOLS AND SURFACTANT ALCOHOL ETHERS, THE RESULTING PRODUCTS AND THEIR USE BASF AKTIENGESELLSCHAFT (DE) 2001-10-10 EP disclosed
WO-2000039058-A1 METHOD FOR PRODUCING SURFACTANT ALCOHOLS AND SURFACTANT ALCOHOL ETHERS, THE RESULTING PRODUCTS AND THEIR USE BASF AKTIENGESELLSCHAFT (DE) 2000-07-06 WO 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 (2 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-20040186325-A1 subjecting olefin mixture to metathesis, separating olefins, dimerizing, derivatizing (via hydroformylation) after fractionation, then alkoxylating; OSTC, ADH1C, PHOSPHO1 TSHR 3588/4885ALDH1A1 609/4885SMN1; SMN2 4065/4885
US-20040030209-A1 Catalytic alkylation using zeolite; sulfonation; neutralization TPSD1, CYP2F1, CYP2S1 TSHR 3391/4885ALDH1A1 2658/4885SMN1; SMN2 1086/4885

“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.