SCHEMBL1787410

SCHEMBL1787410

Nn1nc(-c2ccc(C(F)(F)F)cc2)c2ccccc2c1=O

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 3/20 0.62
KDM4E B2RXH2 1/20 0.62
MAPT P10636 5/20 0.51
MEN1 O00255 1/20 0.51
MAPK1 P28482 1/20 0.51
KMT2A Q03164 1/20 0.51
ALDH1A1 P00352 2/20 0.49
LMNA P02545 1/20 0.49
TP53 P04637 2/20 0.43
GAA P10253 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.42
PTGER1 P34995 1/20 0.42
HPGD P15428 1/20 0.42
TNKS O95271 1/20 0.42
WNT3A P56704 1/20 0.42
TNKS2 Q9H2K2 1/20 0.42
MAOB P27338 1/20 0.42
CFTR P13569 1/20 0.41
TRPV1 Q8NER1 1/20 0.41
ALOX15 P16050 1/20 0.41

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
SCHEMBL1786845 0.83 NPSR1 (0.56) NPSR1KDM4EMAPTMEN1KMT2A
SCHEMBL1788116 0.82 ALDH1A1 (0.57) NPSR1KDM4EMEN1KMT2AALDH1A1
SCHEMBL1788558 0.80 NPSR1 (0.59) NPSR1KDM4EMAPTMEN1KMT2A
SCHEMBL1789226 0.80 NPSR1 (0.64) NPSR1KDM4EMAPTMEN1KMT2A
SCHEMBL1791327 0.80 SMN1; SMN2 (0.61) MAPTMEN1KMT2AALDH1A1TP53
SCHEMBL13721019 0.77 NPSR1 (0.44) NPSR1KDM4EMAPTMEN1MAPK1
SCHEMBL1786120 0.77 NPSR1 (0.46) NPSR1MAPTMEN1KMT2AALDH1A1
SCHEMBL1785806 0.77 KDM4E (0.57) KDM4EMAPTMEN1MAPK1KMT2A
SCHEMBL5292430 0.76 NPSR1 (0.55) NPSR1KDM4EMAPTMEN1MAPK1
SCHEMBL19675302 0.75 NPSR1 (0.42) NPSR1MEN1KMT2AALDH1A1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8629143-B2 Potassium channel modulators ABBVIE INC. (US) 2014-01-14 US disclosed
US-20110124642-A1 POTASSIUM CHANNEL MODULATORS ABBOTT LABORATORIES (US) 2011-05-26 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-20110124642-A1 POTASSIUM CHANNEL MODULATORS KCNQ1, KCNQ2, KCNQ3 NPSR1 505/4885KDM4E 574/4885MAPT 3480/4885

“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.