SCHEMBL957705

SCHEMBL957705

Fc1ccc(Cn2ccc3c(Cl)nccc32)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.52
LMNA P02545 1/20 0.52
KLKB1 P03952 3/20 0.44
KLK1 P06870 3/20 0.44
MAPT P10636 1/20 0.43
THRB P10828 1/20 0.43
ALDH1A1 P00352 2/20 0.43
HTR6 P50406 1/20 0.43
HTT P42858 1/20 0.43
CYP19A1 P11511 3/20 0.42
DBH P09172 1/20 0.42
CYP11B1 P15538 1/20 0.41
CYP11B2 P19099 1/20 0.41
NFATC1 O95644 1/20 0.40
GSK3B P49841 1/20 0.40
DYRK1A Q13627 1/20 0.40
MAOB P27338 1/20 0.39
POLB P06746 1/20 0.38
RAB9A P51151 1/20 0.38
MAPK14 Q16539 1/20 0.38

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
SCHEMBL12601683 0.84 HTR6 (0.50) SMN1; SMN2KLKB1KLK1HTR6CYP19A1
SCHEMBL22533525 0.81 KLKB1 (0.40) SMN1; SMN2LMNAKLKB1KLK1HTR6
SCHEMBL29424694 0.81 KLKB1 (0.40) SMN1; SMN2LMNAKLKB1KLK1HTR6
SCHEMBL18108931 0.76 YTHDC1 (0.46) SMN1; SMN2LMNAHTTCYP11B2RAB9A
SCHEMBL29246282 0.76 FGFR1 (0.56) MAPTTHRBDBH
SCHEMBL30910343 0.76 FGFR1 (0.56) MAPTTHRBDBH
SCHEMBL956866 0.76 FGFR1 (0.56) SMN1; SMN2LMNAMAPTTHRBALDH1A1
SCHEMBL21608523 0.76 RXFP1 (0.36) SMN1; SMN2LMNAKLKB1KLK1MAPT
SCHEMBL21608265 0.75 CYP17A1 (0.36) SMN1; SMN2LMNAKLKB1KLK1MAPT
SCHEMBL6085877 0.75 HTR6 (0.53) SMN1; SMN2LMNAMAPTTHRBALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8450343-B2 Gamma secretase modulators SCHERING CORPORATION 2013-05-28 US disclosed
US-8450343-B2 Gamma secretase modulators SCHERING CORPORATION 2013-05-28 US disclosed
US-8450343-B2 Gamma secretase modulators SCHERING CORPORATION 2013-05-28 US disclosed
US-20110015190-A1 GAMMA SECRETASE MODULATORS SCHERING CORPORATION 2011-01-20 US disclosed
US-20110015190-A1 GAMMA SECRETASE MODULATORS SCHERING CORPORATION 2011-01-20 US disclosed
US-20110015190-A1 GAMMA SECRETASE MODULATORS SCHERING CORPORATION 2011-01-20 US disclosed
CN-101939315-A Gamma secretase modulators SCHERING CORP 2011-01-05 CN disclosed
EP-2229381-A1 GAMMA SECRETASE MODULATORS Schering Corporation (US) 2010-09-22 EP disclosed
WO-2009073777-A1 GAMMA SECRETASE MODULATORS SCHERING CORPORATION (US) 2009-06-11 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-20110015190-A1 GAMMA SECRETASE MODULATORS BACE1, BACE2, PSEN1 SMN1; SMN2 1580/4885LMNA 2080/4885KLKB1 3012/4885

“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.