SCHEMBL1884014

SCHEMBL1884014

COc1cc2c(cc1OC)CN(CCCCNC(=O)c1cc(I)ccc1OCCF)CC2

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TMEM97 Q5BJF2 3/20 0.83
SIGMAR1 Q99720 3/20 0.83
DRD1 P21728 1/20 0.62
DRD4 P21917 1/20 0.62
DRD3 P35462 1/20 0.62

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
SCHEMBL13501680 1.00 TMEM97 (0.83) TMEM97SIGMAR1DRD1DRD4DRD3
SCHEMBL10315940 0.95 TMEM97 (0.75) TMEM97SIGMAR1DRD1DRD4DRD3
SCHEMBL9885517 0.95 SIGMAR1 (0.78) TMEM97SIGMAR1DRD1DRD4DRD3
SCHEMBL9885508 0.95 SIGMAR1 (0.78) TMEM97SIGMAR1DRD1DRD4DRD3
SCHEMBL10010293 0.95 TMEM97 (0.75) TMEM97SIGMAR1DRD1DRD4DRD3
SCHEMBL1891237 0.94 SIGMAR1 (0.73) TMEM97SIGMAR1DRD1DRD4DRD3
SCHEMBL10009787 0.91 SIGMAR1 (0.69) TMEM97SIGMAR1DRD1DRD4DRD3
SCHEMBL10009452 0.91 SIGMAR1 (0.69) TMEM97SIGMAR1DRD1DRD4DRD3
SCHEMBL30967284 0.91 SIGMAR1 (1.00) TMEM97SIGMAR1DRD3
SCHEMBL29352225 0.91 SIGMAR1 (1.00) TMEM97SIGMAR1DRD3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8193360-B2 Radiolabelled fluorobenzamide analogues, their synthesis and use in diagnostic imaging WASHINGTON UNIVERSITY (US) 2012-06-05 US disclosed
US-8193360-B2 Radiolabelled fluorobenzamide analogues, their synthesis and use in diagnostic imaging WASHINGTON UNIVERSITY (US) 2012-06-05 US disclosed
US-20110230662-A1 RADIOLABELLED FLUOROBENZAMIDE ANALOGUES, THEIR SYNTHESIS AND USE IN DIAGNOSTIC IMAGING WASHINGTON UNIVERSITY (US) 2011-09-22 US disclosed
US-20110230662-A1 RADIOLABELLED FLUOROBENZAMIDE ANALOGUES, THEIR SYNTHESIS AND USE IN DIAGNOSTIC IMAGING WASHINGTON UNIVERSITY (US) 2011-09-22 US disclosed
US-7947838-B2 Radiolabelled benzamide analogues, their synthesis and use in diagnostic imaging WASHINGTON UNIVERSITY (US) 2011-05-24 US disclosed
US-7947838-B2 Radiolabelled benzamide analogues, their synthesis and use in diagnostic imaging WASHINGTON UNIVERSITY (US) 2011-05-24 US disclosed
US-20100150836-A1 RADIOLABELLED BENZAMIDE ANALOGUES, THEIR SYNTHESIS AND USE IN DIAGNOSTIC IMAGING WASHINGTON UNIVERSITY (US) 2010-06-17 US disclosed
US-20100150836-A1 RADIOLABELLED BENZAMIDE ANALOGUES, THEIR SYNTHESIS AND USE IN DIAGNOSTIC IMAGING WASHINGTON UNIVERSITY (US) 2010-06-17 US disclosed
EP-2164327-A2 RADIOLABELLED FLUOROBENZAMIDE ANALOGUES, THEIR SYNTHESIS AND USE IN DIAGNOSTIC IMAGING WASHINGTON UNIVERSITY (US) 2010-03-24 EP disclosed
US-7659400-B2 Radiolabelled benzamide analogues, their synthesis and use in diagnostic imaging WASHINGTON UNIVERSITY (US) 2010-02-09 US disclosed
US-7659400-B2 Radiolabelled benzamide analogues, their synthesis and use in diagnostic imaging WASHINGTON UNIVERSITY (US) 2010-02-09 US disclosed
WO-2009025914-A2 RADIOLABELLED FLUOROBENZAMIDE ANALOGUES, THEIR SYNTHESIS AND USE IN DIAGNOSTIC IMAGING WASHINGTON UNIVERSITY (US) 2009-02-26 WO disclosed
US-20080107599-A1 RADIOLABELLED BENZAMIDE ANALOGUES, THEIR SYNTHESIS AND USE IN DIAGNOSTIC IMAGING WASHINGTON UNIVERSITY OF ST. LOUIS 2008-05-08 US disclosed
US-20080107599-A1 RADIOLABELLED BENZAMIDE ANALOGUES, THEIR SYNTHESIS AND USE IN DIAGNOSTIC IMAGING WASHINGTON UNIVERSITY OF ST. LOUIS 2008-05-08 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 (3 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-20080107599-A1 RADIOLABELLED BENZAMIDE ANALOGUES, THEIR SYNTHESIS AND USE IN DIAGNOSTIC IMAGING TMEM97, SIGMAR1, SFN TMEM97 1/4885SIGMAR1 2/4885DRD1 544/4885
US-20100150836-A1 RADIOLABELLED BENZAMIDE ANALOGUES, THEIR SYNTHESIS AND USE IN DIAGNOSTIC IMAGING TMEM97, SIGMAR1, SFN TMEM97 1/4885SIGMAR1 2/4885DRD1 544/4885
US-20110230662-A1 RADIOLABELLED FLUOROBENZAMIDE ANALOGUES, THEIR SYNTHESIS AND USE IN DIAGNOSTIC IMAGING TMEM97, SIGMAR1, SFN TMEM97 1/4885SIGMAR1 2/4885DRD1 537/4885

“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.