SCHEMBL3221871

SCHEMBL3221871

C#CCc1cc(Cl)cc(Cl)c1

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.42
IDO1 P14902 2/20 0.41
PYCR1 P32322 5/20 0.40
L3MBTL1 Q9Y468 1/20 0.33
TP53 P04637 1/20 0.33
CYP3A4 P08684 1/20 0.33
HTR3E A5X5Y0 1/20 0.31
HTR3B O95264 1/20 0.31
HTR3A P46098 1/20 0.31
HTR3D Q70Z44 1/20 0.31
HTR3C Q8WXA8 1/20 0.31
DAO P14920 1/20 0.31
DBH P09172 1/20 0.31
PNMT P11086 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
SCHEMBL5321590 0.77 PYCR1 (0.56) IDO1PYCR1CYP3A4HTR3EHTR3B
SCHEMBL8488912 0.75 HCAR2 (0.35) PYCR1
SCHEMBL10778262 0.74 TSHR (0.42) TSHRIDO1L3MBTL1TP53CYP3A4
SCHEMBL4176549 0.74 TSHR (0.42) TSHRIDO1L3MBTL1TP53CYP3A4
SCHEMBL502201 0.74 KDM4E (0.48) TSHRIDO1L3MBTL1TP53CYP3A4
SCHEMBL1921131 0.74 PYCR1 (0.50) IDO1PYCR1
SCHEMBL28599801 0.72 ALDH1A1 (0.39) TSHRPYCR1TP53CYP3A4
SCHEMBL5252188 0.69 MAOB (0.47) IDO1PYCR1
SCHEMBL3232292 0.69 PYCR1 (0.55) TSHRIDO1PYCR1TP53PNMT
SCHEMBL8658364 0.68 KDM4E (0.48) TSHRIDO1L3MBTL1PNMT

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-20100069244-A1 Pyridine Compounds for Combating Pests BASF SE (DE) 2010-03-18 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-20100069244-A1 Pyridine Compounds for Combating Pests CHRM1, PRDX1, CHRM2 TSHR 1014/4885IDO1 34/4885PYCR1 30/4885

“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.