SCHEMBL22494099

SCHEMBL22494099

CCCCCCCCCCC/C=C\CCCCC(=O)NC(Cc1ccccc1)C(=O)O

nearest known ligand 0.91

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FAAH O00519 4/20 0.91
EPHX2 P34913 6/20 0.64
SLC6A5 Q9Y345 3/20 0.63
CNR1 P21554 2/20 0.61
CNR2 P34972 1/20 0.61
SOAT2 O75908 1/20 0.60
SOAT1 P35610 1/20 0.60
ITGB3 P05106 1/20 0.58
ITGA2B P08514 1/20 0.58
PSMB5 P28074 1/20 0.57
HDAC3 O15379 1/20 0.56
HDAC4 P56524 1/20 0.56
HDAC1 Q13547 1/20 0.56
HDAC7 Q8WUI4 1/20 0.56
HDAC2 Q92769 1/20 0.56
HDAC10 Q969S8 1/20 0.56
HDAC11 Q96DB2 1/20 0.56
HDAC8 Q9BY41 1/20 0.56
HDAC6 Q9UBN7 1/20 0.56
HDAC9 Q9UKV0 1/20 0.56

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
SCHEMBL15285230 1.00 FAAH (0.91) FAAHEPHX2SLC6A5CNR1CNR2
SCHEMBL15285227 1.00 FAAH (0.91) FAAHEPHX2SLC6A5CNR1CNR2
SCHEMBL20398924 1.00 FAAH (0.91) FAAHEPHX2SLC6A5CNR1CNR2
SCHEMBL22494088 1.00 FAAH (0.91) FAAHEPHX2SLC6A5CNR1CNR2
SCHEMBL22494098 1.00 FAAH (0.91) FAAHEPHX2SLC6A5CNR1CNR2
SCHEMBL22494109 1.00 FAAH (0.91) FAAHEPHX2SLC6A5CNR1CNR2
SCHEMBL22494087 1.00 FAAH (0.91) FAAHEPHX2SLC6A5CNR1CNR2
SCHEMBL22494108 1.00 FAAH (0.91) FAAHEPHX2SLC6A5CNR1CNR2
SCHEMBL22494089 1.00 FAAH (0.91) FAAHEPHX2SLC6A5CNR1CNR2
SCHEMBL18797438 1.00 FAAH (0.91) FAAHEPHX2SLC6A5CNR1CNR2

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-11365177-B2 Chemical uncouplers of respiration and methods of use thereof DANA-FARBER CANCER INSTITUTE, INC. (US) 2022-06-21 US disclosed
US-20200317613-A1 CHEMICAL UNCOUPLERS OF RESPIRATION AND METHODS OF USE THEREOF UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INCORPORATED 2020-10-08 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 (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-11365177-B2 Chemical uncouplers of respiration and methods of use thereof PC, UQCRC1, SQOR FAAH 1063/4885EPHX2 1255/4885SLC6A5 3986/4885
US-20200317613-A1 CHEMICAL UNCOUPLERS OF RESPIRATION AND METHODS OF USE THEREOF PC, UQCRC1, SQOR FAAH 1063/4885EPHX2 1255/4885SLC6A5 3986/4885

“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.