SCHEMBL5355170

SCHEMBL5355170

Cc1ccc(SC[C@](O)(CC(C)(C)c2cc(Br)cc3c2OCC3)C(F)(F)F)cc1

nearest known ligand 0.56

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 19/20 0.56
NR3C2 P08235 17/20 0.56
PGR P06401 14/20 0.56
AR P10275 1/20 0.34
MAPT P10636 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
RXFP1 Q9HBX9 1/20 0.33

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
SCHEMBL5355175 1.00 NR3C1 (0.56) NR3C1NR3C2PGRARMAPT
SCHEMBL5370067 0.88 NR3C1 (0.53) NR3C1NR3C2PGRAR
SCHEMBL5370062 0.88 NR3C1 (0.53) NR3C1NR3C2PGRAR
SCHEMBL4476447 0.81 NR3C1 (0.63) NR3C1NR3C2PGRARMAPT
SCHEMBL5349055 0.81 NR3C1 (0.54) NR3C1NR3C2PGRARMAPT
SCHEMBL5360216 0.81 NR3C1 (0.54) NR3C1NR3C2PGRARMAPT
SCHEMBL5349049 0.81 NR3C1 (0.54) NR3C1NR3C2PGRARMAPT
SCHEMBL6510765 0.81 NR3C1 (0.54) NR3C1NR3C2PGRARMAPT
SCHEMBL5349050 0.81 NR3C1 (0.54) NR3C1NR3C2PGRARMAPT
SCHEMBL5360211 0.81 NR3C1 (0.54) NR3C1NR3C2PGRARMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7256300-B2 Stereoselective synthesis of certain trifluoromethyl-substituted alcohols BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) 2007-08-14 US disclosed
US-7256300-B2 Stereoselective synthesis of certain trifluoromethyl-substituted alcohols BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) 2007-08-14 US disclosed
US-20050234250-A1 Stereoselective synthesis of certain trifluoromethyl-substituted alcohols BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) 2005-10-20 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-20050234250-A1 Stereoselective synthesis of certain trifluoromethyl-substituted alcohols NR3C1, NR3C2, MC2R NR3C1 1/4885NR3C2 2/4885PGR 414/4885

“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.