SCHEMBL19299334

SCHEMBL19299334

COC(=O)CCCCCCCCC(C)(C)O

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.56
LMNA P02545 2/20 0.50
ALDH1A1 P00352 1/20 0.50
RECQL P46063 1/20 0.45
KMT2A Q03164 3/20 0.42
CNR1 P21554 1/20 0.40
CNR2 P34972 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
EPHX2 P34913 4/20 0.39
HPGD P15428 1/20 0.38
POLB P06746 1/20 0.38
POLA1 P09884 1/20 0.38
PKM P14618 1/20 0.38
MEN1 O00255 2/20 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
SCHEMBL12926133 0.98 TSHR (0.58) TSHRLMNAALDH1A1RECQLKMT2A
SCHEMBL24383921 0.85 TSHR (0.58) TSHRLMNAALDH1A1RECQLKMT2A
SCHEMBL27507029 0.85 TSHR (0.58) TSHRLMNAALDH1A1RECQLKMT2A
SCHEMBL2935590 0.85 TSHR (0.58) TSHRLMNAALDH1A1RECQLKMT2A
SCHEMBL12933269 0.85 TSHR (0.58) TSHRLMNAALDH1A1RECQLKMT2A
SCHEMBL1478447 0.85 TSHR (0.58) TSHRLMNAALDH1A1RECQLKMT2A
SCHEMBL10611084 0.85 TSHR (0.58) TSHRLMNAALDH1A1RECQLKMT2A
SCHEMBL2254876 0.85 TSHR (0.58) TSHRLMNAALDH1A1RECQLKMT2A
SCHEMBL22712309 0.85 TSHR (0.58) TSHRLMNAALDH1A1RECQLKMT2A
SCHEMBL29375836 0.83 TSHR (0.56) TSHRLMNAALDH1A1RECQLKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170247314-A1 FRAGRANCES FROM THE ESTERS OF FATTY ACIDS P2 SCIENCE, INC. 2017-08-31 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 (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-20170247314-A1 FRAGRANCES FROM THE ESTERS OF FATTY ACIDS ELOVL5, FASN, ELOVL1 TSHR 4078/4885LMNA 3606/4885ALDH1A1 188/4885

“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.