SCHEMBL25757552

SCHEMBL25757552

CCOC(=O)CCCC1CNCC1CCCC(=O)OCC

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.48
ALDH1A1 P00352 2/20 0.44
ALOX15 P16050 2/20 0.44
TDP1 Q9NUW8 2/20 0.44
USP2 O75604 1/20 0.44
SMYD3 Q9H7B4 1/20 0.41
EPHX2 P34913 9/20 0.40
NR1I2 O75469 1/20 0.40
PGR P06401 1/20 0.40
ADORA3 P0DMS8 1/20 0.40
PTGS2 P35354 1/20 0.40
PDE4D Q08499 1/20 0.40
GAA P10253 2/20 0.40
RAB9A P51151 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
MGAM O43451 1/20 0.39
SI P14410 1/20 0.39
MGAM2 Q2M2H8 1/20 0.39
CYP3A4 P08684 1/20 0.38
TSHR P16473 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
SCHEMBL29198889 0.86 CYP1A2 (0.48) CYP1A2ALDH1A1ALOX15TDP1USP2
SCHEMBL13646108 0.80 USP2 (0.41) CYP1A2ALDH1A1ALOX15TDP1USP2
SCHEMBL15926259 0.79 CYP1A2 (0.48) CYP1A2ALDH1A1ALOX15TDP1USP2
SCHEMBL28116925 0.78 CYP1A2 (0.41) CYP1A2ALDH1A1ALOX15TDP1USP2
SCHEMBL24393166 0.78 ALDH1A1 (0.43) CYP1A2ALDH1A1ALOX15TDP1USP2
SCHEMBL25884523 0.77 ALDH1A1 (0.43) CYP1A2ALDH1A1ALOX15TDP1USP2
Hydrochloric Acid SCHEMBL23215573 0.76 ALDH1A1 (0.42) CYP1A2ALDH1A1ALOX15TDP1USP2
SCHEMBL852008 0.76 CYP1A2 (0.46) CYP1A2ALDH1A1ALOX15TDP1USP2
SCHEMBL28783772 0.76 CYP1A2 (0.42) CYP1A2ALDH1A1ALOX15TDP1USP2
Hydrochloric Acid SCHEMBL29602469 0.75 GNAO1 (0.46) CYP1A2ALDH1A1ALOX15TDP1USP2

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-20230202977-A1 CYCLIC LIPIDS AND METHODS OF USE THEREOF RENAGADE THERAPEUTICS MANAGEMENT INC. 2023-06-29 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-20230202977-A1 CYCLIC LIPIDS AND METHODS OF USE THEREOF SGMS1, SGMS2, LNPEP CYP1A2 4878/4885ALDH1A1 4882/4885ALOX15 1197/4885

“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.