SCHEMBL3615832

SCHEMBL3615832

Cc1nn(C)c(Sc2cc(O)c(Cl)cc2Cl)c1/C=N/O

nearest known ligand 0.44

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.37
HTT P42858 3/20 0.33
ALOX15 P16050 1/20 0.33
MAPT P10636 1/20 0.31
NR2F2 P24468 1/20 0.31
ALDH1A1 P00352 1/20 0.31
GAA P10253 1/20 0.30

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
SCHEMBL3615837 1.00 SMN1; SMN2 (0.37) SMN1; SMN2HTTALOX15MAPTNR2F2
SCHEMBL3608712 0.86 SMN1; SMN2 (0.39) SMN1; SMN2HTTMAPTNR2F2ALDH1A1
SCHEMBL3603064 0.85 MAPT (0.32) SMN1; SMN2HTTMAPTNR2F2
SCHEMBL3614211 0.80 HPGD (0.33) MAPTALDH1A1
SCHEMBL3615104 0.78 ALDH1A1 (0.36) SMN1; SMN2MAPTALDH1A1GAA
SCHEMBL3613878 0.78 ALDH1A1 (0.36) SMN1; SMN2MAPTALDH1A1GAA
SCHEMBL3613880 0.78 ALDH1A1 (0.36) SMN1; SMN2MAPTALDH1A1GAA
SCHEMBL3602203 0.76 NPC1 (0.31) SMN1; SMN2
SCHEMBL3596945 0.75 TDP1 (0.41) ALDH1A1
SCHEMBL9674680 0.74 ALDH1A1 (0.48) SMN1; SMN2HTTALOX15MAPTALDH1A1

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-20100016396-A1 PYRAZOLE COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-01-21 US disclosed
EP-2128138-A1 PYRAZOLE COMPOUND Takeda Pharmaceutical Company Limited (JP) 2009-12-02 EP 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-20100016396-A1 PYRAZOLE COMPOUND SLC5A1, SLC5A2, GLP1R SMN1; SMN2 4515/4885HTT 4008/4885ALOX15 1991/4885

“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.