SCHEMBL22494093

SCHEMBL22494093

CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCC(=O)NC(Cc1ccccc1)C(=O)O

nearest known ligand 0.61

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FAAH O00519 4/20 0.61
ALDH1A1 P00352 2/20 0.59
MAPT P10636 1/20 0.59
EPHX2 P34913 3/20 0.53
ACE P12821 6/20 0.52
CNR1 P21554 1/20 0.51
CNR2 P34972 1/20 0.51
NAALAD2 Q9Y3Q0 1/20 0.48
MME P08473 2/20 0.47
CPA1 P15085 1/20 0.47
ACE2 Q9BYF1 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47

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
SCHEMBL22494092 1.00 FAAH (0.61) FAAHALDH1A1MAPTEPHX2ACE
SCHEMBL26624454 0.94 FAAH (0.64) FAAHALDH1A1MAPTEPHX2ACE
SCHEMBL26624443 0.94 FAAH (0.64) FAAHALDH1A1MAPTEPHX2ACE
SCHEMBL22494111 0.93 FAAH (0.68) FAAHALDH1A1MAPTEPHX2ACE
SCHEMBL22494113 0.93 FAAH (0.68) FAAHALDH1A1MAPTEPHX2ACE
SCHEMBL31026991 0.91 FAAH (0.73) FAAHEPHX2CNR1CNR2
SCHEMBL15285026 0.90 FAAH (0.76) FAAHEPHX2CNR1CNR2
SCHEMBL18585828 0.85 ALOX12 (0.63) FAAHALDH1A1MAPTACEMME
SCHEMBL18619563 0.85 ALOX12 (0.63) FAAHALDH1A1MAPTACEMME
SCHEMBL18585826 0.85 ALOX12 (0.63) FAAHALDH1A1MAPTACEMME

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 1063/4885ALDH1A1 352/4885MAPT 4698/4885
US-20200317613-A1 CHEMICAL UNCOUPLERS OF RESPIRATION AND METHODS OF USE THEREOF PC, UQCRC1, SQOR FAAH 1063/4885ALDH1A1 352/4885MAPT 4698/4885

“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.