SCHEMBL18778786

SCHEMBL18778786

CCCCOc1ccc(C(=O)/C=C/c2ccc(C)cc2)cc1

nearest known ligand 0.80

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ABCG2 Q9UNQ0 3/20 0.80
MAOB P27338 8/20 0.80
MAOA P21397 1/20 0.68
MAPT P10636 1/20 0.67
BCHE P06276 5/20 0.66
CYP1A1 P04798 1/20 0.65
CYP1B1 Q16678 1/20 0.65
ACHE P22303 3/20 0.65

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
SCHEMBL10497493 0.96 ABCG2 (0.74) ABCG2MAOBMAOAMAPTBCHE
SCHEMBL10497417 0.96 ABCG2 (0.74) ABCG2MAOBMAOAMAPTBCHE
SCHEMBL23788887 0.92 ABCG2 (0.84) ABCG2MAOBBCHECYP1A1CYP1B1
SCHEMBL29014210 0.89 MAOB (0.71) ABCG2MAOBMAOAMAPTBCHE
SCHEMBL29014271 0.89 MAOB (0.71) ABCG2MAOBMAOAMAPTBCHE
SCHEMBL29181783 0.89 MAOB (0.71) ABCG2MAOBMAOAMAPTBCHE
SCHEMBL25218115 0.89 ABCG2 (1.00) ABCG2MAOBMAPTBCHECYP1A1
SCHEMBL25265255 0.89 ABCG2 (1.00) ABCG2MAOBMAPTBCHECYP1A1
SCHEMBL25195480 0.89 ABCG2 (1.00) ABCG2MAOBMAPTBCHECYP1A1
SCHEMBL10497614 0.89 MAOB (1.00) ABCG2MAOBMAOAMAPTCYP1A1

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-9974778-B2 Substituted pyridinones as MGAT2 inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2018-05-22 US disclosed
US-20170114054-A1 SUBSTITUTED PYRIDINONES AS MGAT2 INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2017-04-27 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-20170114054-A1 SUBSTITUTED PYRIDINONES AS MGAT2 INHIBITORS PLAAT2, ACAT2, MGAT2 ABCG2 264/4885MAOB 233/4885MAOA 334/4885

“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.