SCHEMBL20049883

SCHEMBL20049883

CCCCCCCC(C)(CCCCCC)c1cc(F)[nH]n1

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 3/20 0.35
LMNA P02545 1/20 0.33
MAPT P10636 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
ALDH1A1 P00352 1/20 0.33
HPGD P15428 1/20 0.33
HCAR3 P49019 2/20 0.33
CNR2 P34972 2/20 0.32
SOD3 P08294 1/20 0.30
CNR1 P21554 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
SCHEMBL19779338 1.00 HCAR2 (0.35) HCAR2LMNAMAPTSMN1; SMN2ALDH1A1
SCHEMBL21719609 1.00 HCAR2 (0.35) HCAR2LMNAMAPTSMN1; SMN2ALDH1A1
SCHEMBL19618178 0.94 HCAR2 (0.33) HCAR2LMNAMAPTSMN1; SMN2ALDH1A1
SCHEMBL23583949 0.82 CYP1A2 (0.38) HCAR2LMNAMAPTSMN1; SMN2ALDH1A1
SCHEMBL21718612 0.82 CYP1A2 (0.38) HCAR2LMNAMAPTSMN1; SMN2ALDH1A1
SCHEMBL20049986 0.82 CYP1A2 (0.38) HCAR2LMNAMAPTSMN1; SMN2ALDH1A1
SCHEMBL21719791 0.81 CNR2 (0.32) HCAR2LMNAMAPTSMN1; SMN2ALDH1A1
SCHEMBL21719757 0.81 CNR2 (0.32) HCAR2LMNAMAPTSMN1; SMN2ALDH1A1
SCHEMBL21720041 0.81 CNR2 (0.32) HCAR2LMNAMAPTSMN1; SMN2ALDH1A1
SCHEMBL21719755 0.78 GPR84 (0.36) HCAR2MAPTCNR2CNR1

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-20180098983-A1 CERTAIN CHEMICAL ENTITIES, COMPOSITIONS AND METHODS INTELLIKINE, INC. 2018-04-12 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-20180098983-A1 CERTAIN CHEMICAL ENTITIES, COMPOSITIONS AND METHODS PIK3CA, AKT3, PIK3C2A HCAR2 3401/4885LMNA 691/4885MAPT 2419/4885

“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.