SCHEMBL3969050

SCHEMBL3969050

O=C(O)CCCCC(=O)OC(O)CCCCCCCCC(O)O

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 2/20 0.44
FFAR1 O14842 2/20 0.44
LMNA P02545 4/20 0.43
TSHR P16473 2/20 0.43
NFKB1 P19838 1/20 0.43
PMP22 Q01453 1/20 0.43
GSTK1 Q9Y2Q3 2/20 0.42
ALDH1A1 P00352 2/20 0.40
ENPEP Q07075 1/20 0.38
GPR84 Q9NQS5 1/20 0.38

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
SCHEMBL8523520 0.98 FFAR4 (0.42) FFAR4FFAR1LMNATSHRNFKB1
SCHEMBL11021433 0.92 GSTK1 (0.44) FFAR4FFAR1LMNATSHRNFKB1
SCHEMBL28688931 0.91 LMNA (0.44) FFAR4FFAR1LMNATSHRNFKB1
SCHEMBL21633939 0.89 LMNA (0.42) FFAR4FFAR1LMNATSHRNFKB1
SCHEMBL8661641 0.88 FFAR1 (0.55) FFAR4FFAR1LMNATSHRNFKB1
SCHEMBL28830391 0.88 FFAR1 (0.55) FFAR4FFAR1LMNATSHRNFKB1
SCHEMBL28075980 0.88 FFAR1 (0.55) FFAR4FFAR1LMNATSHRNFKB1
SCHEMBL9875093 0.88 FFAR1 (0.55) FFAR4FFAR1LMNATSHRNFKB1
SCHEMBL28076073 0.88 FFAR1 (0.55) FFAR4FFAR1LMNATSHRNFKB1
SCHEMBL28076156 0.88 FFAR1 (0.55) FFAR4FFAR1LMNATSHRNFKB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8318868-B2 Isocyanate-containing thermoplastic polyurethane BASF AKTIENGESELLSCHAFT (DE) 2012-11-27 US disclosed
US-7498379-B2 Carbodiimides containing urea groups and silyl-groups BASF AKTIENGESELLSCHAFT (DE) 2009-03-03 US disclosed
US-20080207846-A1 Isocyanate-Containing Thermoplastic Polyurethane BASF AKTIENGESELLSCHAFT PATENTS, TRADEMARKS AND LICENSES (DE) 2008-08-28 US disclosed
US-20080015294-A1 Carbodiimides Containing Urea Groups and Silane Groups BASF AKTIENGESELLSCHAFT (DE) 2008-01-17 US disclosed
US-20070208158-A1 Polyurethane Containing Carbodiimides BASF AKTIENGESELLSCHAFT (DE) 2007-09-06 US disclosed
EP-0922552-B1 Process for continuous production of granules of thermoplastic polyurethanelastomers BASF AG (DE) 2004-09-22 EP disclosed
EP-0922552-A1 Process for continuous production of granules of thermoplastic polyurethanelastomers BASF AKTIENGESELLSCHAFT (DE) 1999-06-16 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 (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-20080015294-A1 Carbodiimides Containing Urea Groups and Silane Groups HRH4, HRH3, OXER1 FFAR4 443/4885FFAR1 226/4885LMNA 2144/4885

“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.