SCHEMBL4226669

SCHEMBL4226669

Brc1ccc2c(c1)/C(=C\c1c[nH]cn1)CC2

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 14/20 0.44
CYP11B2 P19099 12/20 0.44
CYP11B1 P15538 8/20 0.44
TDP1 Q9NUW8 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
PARP1 P09874 1/20 0.37
PARP10 Q53GL7 1/20 0.37
MAOA P21397 1/20 0.36
MAOB P27338 1/20 0.36
TYMS P04818 2/20 0.35

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
SCHEMBL4226665 1.00 CYP19A1 (0.44) CYP19A1CYP11B2CYP11B1TDP1L3MBTL1
SCHEMBL13229260 0.92 CYP19A1 (0.41) CYP19A1CYP11B2CYP11B1TDP1L3MBTL1
SCHEMBL4231848 0.89 CYP19A1 (0.56) CYP19A1CYP11B2CYP11B1PARP10
SCHEMBL4231849 0.89 CYP19A1 (0.56) CYP19A1CYP11B2CYP11B1PARP10
SCHEMBL4234962 0.83 CYP19A1 (0.48) CYP19A1CYP11B2CYP11B1PARP1PARP10
SCHEMBL4234960 0.83 CYP19A1 (0.48) CYP19A1CYP11B2CYP11B1PARP1PARP10
SCHEMBL4226486 0.83 CYP11B2 (0.44) CYP19A1CYP11B2CYP11B1PARP1PARP10
SCHEMBL4226487 0.83 CYP11B2 (0.44) CYP19A1CYP11B2CYP11B1PARP1PARP10
SCHEMBL13229552 0.80 TYRO3 (0.37) CYP19A1CYP11B2CYP11B1PARP10MAOB
SCHEMBL4221234 0.80 CYP19A1 (0.57) CYP19A1CYP11B2CYP11B1MAOAMAOB

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-20090105278-A1 Selective inhibitors of human corticosteroid syntheses UNIVERSITAT DES SAARLANDES (DE) 2009-04-23 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-20090105278-A1 Selective inhibitors of human corticosteroid syntheses HSD11B1, HSD11B2, CYP11B1 CYP19A1 76/4885CYP11B2 5/4885CYP11B1 3/4885

“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.