SCHEMBL13097699

SCHEMBL13097699

Cc1c(C(C)C)ccc(C#N)c1C(F)(F)F

nearest known ligand 0.56

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
AR P10275 18/20 0.56
PGR P06401 3/20 0.43

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
SCHEMBL13216378 0.81 AR (0.64) AR
SCHEMBL10801178 0.79 LMNA (0.34) AR
SCHEMBL29217863 0.78 AR (0.46) ARPGR
SCHEMBL12812528 0.78 AR (0.60) ARPGR
SCHEMBL13797363 0.77 AR (0.45) AR
SCHEMBL24002450 0.77 AR (0.46) ARPGR
SCHEMBL14116511 0.77 AR (0.38) AR
SCHEMBL221885 0.77 AR (0.58) ARPGR
SCHEMBL15031390 0.76 GPR55 (0.33) AR
SCHEMBL1291612 0.75 AR (0.57) ARPGR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100256180-A1 FUSED HETEROCYCLIC COMPOUNDS USEFUL AS MODULATORS OF NUCLEAR HORMONE RECEPTOR FUNCTION BRISTOL-MYERS SQUIBB COMAPANY (US) 2010-10-07 US disclosed
US-7468439-B2 Alkylene bridged sultam compounds useful as modulators of nuclear hormone receptor function BRISTOL-MYERS SQUIBB COMPANY (US) 2008-12-23 US disclosed
US-7468439-B2 Alkylene bridged sultam compounds useful as modulators of nuclear hormone receptor function BRISTOL-MYERS SQUIBB COMPANY (US) 2008-12-23 US disclosed
US-20080090883-A1 ALKYLENE BRIDGED SULTAM COMPOUNDS USEFUL AS MODULATORS OF NUCLEAR HORMONE RECEPTOR FUNCTION BRISTOL-MYERS SQUIBB COMPANY 2008-04-17 US disclosed
US-20080090883-A1 ALKYLENE BRIDGED SULTAM COMPOUNDS USEFUL AS MODULATORS OF NUCLEAR HORMONE RECEPTOR FUNCTION BRISTOL-MYERS SQUIBB COMPANY 2008-04-17 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 (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-20080090883-A1 ALKYLENE BRIDGED SULTAM COMPOUNDS USEFUL AS MODULATORS OF NUCLEAR HORMONE RECEPTOR FUNCTION SULT2A1, SULT1A1, NR5A1 AR 42/4885PGR 82/4885
US-20100256180-A1 FUSED HETEROCYCLIC COMPOUNDS USEFUL AS MODULATORS OF NUCLEAR HORMONE RECEPTOR FUNCTION NR5A1, AR, ESRRA AR 2/4885PGR 39/4885

“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.