SCHEMBL9279331

SCHEMBL9279331

Cc1cc2c(c(C(F)(F)F)c1)CC[C@@H]2O

nearest known ligand 0.51

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
UGT2B17 O75795 2/20 0.51
CYP11B1 P15538 5/20 0.42
CYP11B2 P19099 5/20 0.42
HTR2A P28223 1/20 0.35
HTR2C P28335 1/20 0.35
HTR2B P41595 1/20 0.35
S1PR1 P21453 4/20 0.34
SYK P43405 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
SCHEMBL15532270 0.81 CYP11B1 (0.46) UGT2B17CYP11B1CYP11B2S1PR1
SCHEMBL1508635 0.81 CYP11B1 (0.46) UGT2B17CYP11B1CYP11B2S1PR1
SCHEMBL15533210 0.80 CYP11B1 (0.42) UGT2B17CYP11B1CYP11B2HTR2AHTR2C
SCHEMBL15532010 0.80 CYP11B1 (0.42) UGT2B17CYP11B1CYP11B2S1PR1
SCHEMBL1508636 0.77 UGT2B17 (0.82) UGT2B17CYP11B1CYP11B2
SCHEMBL30786045 0.74 UGT2B17 (0.56) UGT2B17
SCHEMBL20362246 0.74 UGT2B17 (0.56) UGT2B17
SCHEMBL16369272 0.73 CYP11B1 (0.45) UGT2B17CYP11B1CYP11B2S1PR1
SCHEMBL1508485 0.72 CYP11B1 (0.44) CYP11B1CYP11B2HTR2CS1PR1
SCHEMBL15531953 0.72 CYP11B1 (0.44) CYP11B1CYP11B2HTR2CS1PR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2646425-B1 Indanyloxydihydrobenzofuranylacetic acids useful for the treatment of metabolic syndrome BOEHRINGER INGELHEIM INT (DE) 2015-06-10 EP disclosed
EP-2646425-B1 Indanyloxydihydrobenzofuranylacetic acids useful for the treatment of metabolic syndrome BOEHRINGER INGELHEIM INT (DE) 2015-06-10 EP disclosed
EP-2646425-A1 INDANYLOXYDIHYDROBENZOFURANYLACETIC ACIDS Boehringer Ingelheim International GmbH (DE) 2013-10-09 EP disclosed
US-20120302566-A1 INDANYLOXYDIHYDROBENZOFURANYLACETIC ACIDS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-11-29 US disclosed
US-20120302566-A1 INDANYLOXYDIHYDROBENZOFURANYLACETIC ACIDS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-11-29 US disclosed
US-20120302566-A1 INDANYLOXYDIHYDROBENZOFURANYLACETIC ACIDS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-11-29 US disclosed
WO-2012072691-A1 INDANYLOXYDIHYDROBENZOFURANYLACETIC ACIDS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-06-07 WO disclosed
WO-2012072691-A1 INDANYLOXYDIHYDROBENZOFURANYLACETIC ACIDS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-06-07 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 (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-20120302566-A1 INDANYLOXYDIHYDROBENZOFURANYLACETIC ACIDS GPR119, INSR, GPR52 UGT2B17 972/4885CYP11B1 383/4885CYP11B2 482/4885

“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.