SCHEMBL4042550

SCHEMBL4042550

Fc1ccc2c(c1)CCc1ncccc1/C2=C\Br

nearest known ligand 0.48

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 4/20 0.48
CYP11B2 P19099 13/20 0.45
CYP11B1 P15538 10/20 0.43
CYP19A1 P11511 10/20 0.43
PTAFR P25105 1/20 0.38

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
SCHEMBL4038030 1.00 MAPK14 (0.48) MAPK14CYP11B2CYP11B1CYP19A1PTAFR
SCHEMBL4038027 1.00 MAPK14 (0.48) MAPK14CYP11B2CYP11B1CYP19A1PTAFR
SCHEMBL13802023 0.86 MAPK14 (0.51) MAPK14CYP11B2CYP11B1CYP19A1PTAFR
SCHEMBL13802018 0.86 MAPK14 (0.51) MAPK14CYP11B2CYP11B1CYP19A1PTAFR
SCHEMBL8352251 0.84 CYP11B2 (0.48) MAPK14CYP11B2CYP11B1CYP19A1PTAFR
SCHEMBL8352428 0.84 CYP11B2 (0.48) MAPK14CYP11B2CYP11B1CYP19A1PTAFR
SCHEMBL8352768 0.83 CYP11B2 (0.49) MAPK14CYP11B2CYP11B1CYP19A1PTAFR
SCHEMBL13802964 0.83 CYP11B2 (0.49) MAPK14CYP11B2CYP11B1CYP19A1PTAFR
SCHEMBL4165095 0.83 MIF (0.39) MAPK14CYP11B2CYP11B1CYP19A1
SCHEMBL4161576 0.83 MIF (0.39) MAPK14CYP11B2CYP11B1CYP19A1

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090149445-A1 TRICYCLIC STEROID HORMONE NUCLEAR RECEPTOR MODULATORS COGHLAN MICHAEL JOSEPH 2009-06-11 US disclosed
US-20090149445-A1 TRICYCLIC STEROID HORMONE NUCLEAR RECEPTOR MODULATORS COGHLAN MICHAEL JOSEPH 2009-06-11 US disclosed
US-20090149445-A1 TRICYCLIC STEROID HORMONE NUCLEAR RECEPTOR MODULATORS COGHLAN MICHAEL JOSEPH 2009-06-11 US disclosed
EP-1519915-B1 TRICYCLIC STEROID HORMONE NUCLEAR RECEPTOR MODULATORS LILLY CO ELI (US) 2009-05-27 EP disclosed
EP-1519915-B1 TRICYCLIC STEROID HORMONE NUCLEAR RECEPTOR MODULATORS LILLY CO ELI (US) 2009-05-27 EP disclosed
US-7411072-B2 Tricyclic steroid hormone nuclear receptor modulators ELI LILLY AND COMPANY (US) 2008-08-12 US disclosed
US-7411072-B2 Tricyclic steroid hormone nuclear receptor modulators ELI LILLY AND COMPANY (US) 2008-08-12 US disclosed
US-7411072-B2 Tricyclic steroid hormone nuclear receptor modulators ELI LILLY AND COMPANY (US) 2008-08-12 US disclosed
US-20060063759-A1 Tricyclic steroid hormone nuclear receptor modulators ELI LILLY AND COMPANY 2006-03-23 US disclosed
WO-2004052847-A2 TRICYCLIC STEROID HORMONE NUCLEAR RECEPTOR MODULATORS ELI LILLY AND COMPANY (US) 2004-06-24 WO 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 (2 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-20090149445-A1 TRICYCLIC STEROID HORMONE NUCLEAR RECEPTOR MODULATORS NR5A1, NR3C2, NR3C1 MAPK14 1472/4885CYP11B2 15/4885CYP11B1 14/4885
US-20060063759-A1 Tricyclic steroid hormone nuclear receptor modulators NR5A1, NR3C2, NR3C1 MAPK14 1545/4885CYP11B2 17/4885CYP11B1 15/4885

“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.