SCHEMBL1996755

SCHEMBL1996755

CCOC(=O)Cc1nn(C[C@@H]2CCN(C)C[C@@H]2F)c2ccccc12

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
RECQL P46063 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.46
ALDH1A1 P00352 1/20 0.45
SLC6A4 P31645 12/20 0.42
HTR2A P28223 7/20 0.42
NPY1R P25929 3/20 0.40
HTR2C P28335 5/20 0.40

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
SCHEMBL1996758 1.00 RECQL (0.47) RECQLSMN1; SMN2ALDH1A1SLC6A4HTR2A
SCHEMBL1996759 1.00 RECQL (0.47) RECQLSMN1; SMN2ALDH1A1SLC6A4HTR2A
SCHEMBL1991766 0.86 NPY1R (0.40) ALDH1A1HTR2ANPY1RHTR2C
SCHEMBL1991769 0.86 NPY1R (0.40) ALDH1A1HTR2ANPY1RHTR2C
SCHEMBL1991767 0.86 NPY1R (0.40) ALDH1A1HTR2ANPY1RHTR2C
SCHEMBL1998303 0.86 RECQL (0.53) RECQLSMN1; SMN2ALDH1A1SLC6A4HTR2A
SCHEMBL1991434 0.85 L3MBTL1 (0.44) RECQLSMN1; SMN2ALDH1A1SLC6A4HTR2A
SCHEMBL1991437 0.85 L3MBTL1 (0.44) RECQLSMN1; SMN2ALDH1A1SLC6A4HTR2A
SCHEMBL1991515 0.84 RECQL (0.55) RECQLSMN1; SMN2ALDH1A1SLC6A4HTR2A
SCHEMBL1998943 0.83 RECQL (0.50) RECQLSMN1; SMN2ALDH1A1SLC6A4HTR2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110152243-A1 NOVEL THIENOPYRROLE COMPOUNDS ABBOTT LABORATORIES (US) 2011-06-23 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-20110152243-A1 NOVEL THIENOPYRROLE COMPOUNDS TPMT, TSLP, THPO RECQL 3604/4885SMN1; SMN2 2548/4885ALDH1A1 297/4885

“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.