SCHEMBL12944934

SCHEMBL12944934

BCc1cc(C)cc(C=O)c1

nearest known ligand 0.38

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ CYP2A6 P11509 1/20 0.38
▸ MAOA P21397 2/20 0.36
▸ MAOB P27338 2/20 0.36
▸ ERN1 O75460 1/20 0.34
▸ PGK1 P00558 1/20 0.32
▸ PGK2 P07205 1/20 0.32
▸ SRC P12931 1/20 0.32

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
SCHEMBL29958234 0.81 CYP2A6 (0.39) CYP2A6MAOAMAOBERN1PGK1
SCHEMBL14017919 0.81 CYP2A6 (0.39) CYP2A6MAOAMAOBERN1PGK1
SCHEMBL501537 0.79 CYP2A6 (0.38) CYP2A6MAOAMAOBERN1PGK1
SCHEMBL26049058 0.79 ERN1 (0.39) CYP2A6MAOAMAOBERN1PGK1
SCHEMBL28027680 0.78 FFAR4 (0.39) CYP2A6MAOAMAOBERN1PGK1
SCHEMBL280640 0.77 CYP2A6 (0.52) CYP2A6ERN1SRC
SCHEMBL3129625 0.77 CYP2A6 (0.52) CYP2A6ERN1SRC
SCHEMBL15591000 0.77 ALDH1A1 (0.40) MAOAPGK1PGK2
SCHEMBL13985153 0.77 PGK1 (0.42) PGK1PGK2
SCHEMBL17749096 0.76 CYP2A6 (0.35) CYP2A6MAOAMAOBERN1

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-20110021586-A1 PHENYL-SULFAMATES AS AROMATASE INHIBITORS STERIX, LIMITED (GB) 2011-01-27 — — US disclosed
US-7763642-B2 Phenyl-sulfamates as aromatase inhibitors STERIX LTD. (GB) 2010-07-27 — — 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-20110021586-A1 PHENYL-SULFAMATES AS AROMATASE INHIBITORS CYP19A1, CYP17A1, CYP21A2 CYP2A6 109/4885MAOA 142/4885MAOB 61/4885

“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.

Send feedback