SCHEMBL1745534

SCHEMBL1745534

OC1CCc2cc(-c3ccc(F)cc3)ccc21

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP17A1 P05093 7/20 0.55
CYP3A4 P08684 7/20 0.55
CYP11B2 P19099 6/20 0.55
CYP11B1 P15538 3/20 0.55
GFRA3 O60609 1/20 0.50
RET P07949 1/20 0.50
PGR P06401 2/20 0.48
KDM1A O60341 2/20 0.45
CYP1A1 P04798 1/20 0.38
CYP1B1 Q16678 1/20 0.38
HDAC3 O15379 1/20 0.38
HDAC1 Q13547 1/20 0.38
HDAC2 Q92769 1/20 0.38
CAMK2A Q9UQM7 1/20 0.37
SRD5A1 P18405 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
SCHEMBL1745527 0.85 SRD5A1 (0.45) CYP17A1CYP3A4CYP11B2CYP11B1GFRA3
SCHEMBL16363081 0.85 SRD5A1 (0.45) CYP17A1CYP3A4CYP11B2CYP11B1GFRA3
SCHEMBL16363092 0.85 SRD5A1 (0.45) CYP17A1CYP3A4CYP11B2CYP11B1GFRA3
SCHEMBL1744877 0.84 GFRA3 (0.62) CYP17A1CYP3A4CYP11B2CYP11B1GFRA3
SCHEMBL19116602 0.84 GFRA3 (0.51) CYP17A1CYP3A4CYP11B2CYP11B1GFRA3
SCHEMBL1745279 0.83 GFRA3 (0.50) CYP17A1CYP3A4CYP11B2CYP11B1GFRA3
SCHEMBL1745326 0.83 PGR (0.51) CYP17A1CYP3A4CYP11B2CYP11B1GFRA3
SCHEMBL28755063 0.80 GFRA3 (0.48) CYP17A1CYP3A4CYP11B2CYP11B1GFRA3
SCHEMBL1744785 0.79 PGR (0.48) CYP3A4GFRA3RETPGRKDM1A
SCHEMBL5439689 0.79 PGR (0.61) CYP11B2CYP11B1GFRA3RETPGR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1559422-B1 RECEPTOR FUNCTION CONTROLLING AGENT TAKEDA PHARMACEUTICAL (JP) 2014-04-30 EP disclosed
EP-2385032-A1 GPR40 Receptor function regulator Takeda Pharmaceutical Company Limited (JP) 2011-11-09 EP disclosed
US-7960369-B2 Receptor function regulator TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2011-06-14 US disclosed
US-20090012093-A1 Receptor Function Regulator TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-01-08 US disclosed
CN-1735408-A Receptor function controlling agent TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2006-02-15 CN disclosed
EP-1559422-A1 RECEPTOR FUNCTION CONTROLLING AGENT Takeda Pharmaceutical Company Limited (JP) 2005-08-03 EP 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-20090012093-A1 Receptor Function Regulator GPR119, GIPR, INSR CYP17A1 2361/4885CYP3A4 3431/4885CYP11B2 2975/4885

“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.