SCHEMBL1880556

SCHEMBL1880556

CC(CCCCC(=O)O)OC(=O)CCCCCCO

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 2/20 0.53
FFAR4 Q5NUL3 2/20 0.53
GPR84 Q9NQS5 1/20 0.53
LMNA P02545 3/20 0.43
FAAH O00519 4/20 0.42
CAMK2A Q9UQM7 1/20 0.42
CNR1 P21554 1/20 0.42
CNR2 P34972 1/20 0.42
ALDH1A1 P00352 2/20 0.41
MAPT P10636 1/20 0.41
MAPK1 P28482 1/20 0.41
TSHR P16473 2/20 0.40
NFKB1 P19838 1/20 0.40
PMP22 Q01453 1/20 0.40
GSTK1 Q9Y2Q3 1/20 0.40

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
SCHEMBL1003524 1.00 FFAR1 (0.53) FFAR1FFAR4GPR84LMNAFAAH
SCHEMBL28729976 0.93 LMNA (0.48) FFAR1FFAR4GPR84LMNAFAAH
SCHEMBL6411243 0.91 LMNA (0.46) FFAR1FFAR4GPR84LMNAFAAH
SCHEMBL17165699 0.88 GPR84 (0.44) FFAR1FFAR4GPR84LMNACAMK2A
SCHEMBL22616821 0.88 TSHR (0.44) FFAR1FFAR4GPR84LMNACAMK2A
SCHEMBL22589990 0.87 LMNA (0.61) FFAR1FFAR4GPR84LMNAFAAH
SCHEMBL7945802 0.87 LMNA (0.61) FFAR1FFAR4GPR84LMNAFAAH
SCHEMBL21807009 0.87 LMNA (0.61) LMNAFAAHCNR1CNR2ALDH1A1
SCHEMBL13133199 0.87 LMNA (0.43) FFAR1FFAR4GPR84LMNAFAAH
SCHEMBL7959647 0.87 LMNA (0.61) FFAR1FFAR4GPR84LMNAFAAH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110105417-A1 Drug Conjugates THE CURATORS OF THE UNIVERSITY OF MISSOURI 2011-05-05 US disclosed
WO-2009158633-A1 DRUG CONJUGATES CURATORS OF THE UNIVERSITY OF MISSOURI ON BEHALF OF THE UNIVERSITY OF MISSOURI-KANSAS CITY (US) 2009-12-30 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 (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-20110105417-A1 Drug Conjugates ABCB1, SLCO2B1, ABCG2 FFAR1 374/4885FFAR4 368/4885GPR84 428/4885

“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.