SCHEMBL23845802

SCHEMBL23845802

CNC(C)(CCCI)C(=O)O

nearest known ligand 0.38

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
NAALAD2 Q9Y3Q0 1/20 0.38
ACLY P53396 1/20 0.31
FFAR1 O14842 1/20 0.30
CPT2 P23786 1/20 0.30
TDP1 Q9NUW8 1/20 0.30

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
SCHEMBL7924611 0.78 ODC1 (0.37) NAALAD2ACLYFFAR1CPT2TDP1
SCHEMBL7741623 0.78 CES2 (0.41) FFAR1TDP1
SCHEMBL6567609 0.78 ODC1 (0.37) NAALAD2ACLYFFAR1CPT2TDP1
Hydrochloric Acid SCHEMBL15799582 0.76 CES2 (0.40) FFAR1TDP1
SCHEMBL18673261 0.76 ABCC4 (0.39) NAALAD2ACLY
SCHEMBL31023888 0.76 KDM4A (0.40) NAALAD2ACLYFFAR1CPT2TDP1
Hydrochloric Acid SCHEMBL15799742 0.76 CES2 (0.40) FFAR1TDP1
SCHEMBL27860885 0.76 NAALAD2 (0.42) NAALAD2TDP1
SCHEMBL3457184 0.76 NAALAD2 (0.42) NAALAD2TDP1
SCHEMBL18492198 0.75 CYP1A2 (0.38) NAALAD2

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-20210290761-A1 ANTI-PARASITIC IMMUNOLOGICAL COMPOSITIONS AL-MURRANI, SAMER 2021-09-23 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-20210290761-A1 ANTI-PARASITIC IMMUNOLOGICAL COMPOSITIONS C3AR1, C5AR1, C5AR2 NAALAD2 201/4885ACLY 3651/4885FFAR1 2537/4885

“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.