SCHEMBL3211981

SCHEMBL3211981

C#CCC([CH2])c1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 1/20 0.36
TAAR1 Q96RJ0 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.35
CYP2C19 P33261 1/20 0.34
TSHR P16473 2/20 0.33
MIF P14174 2/20 0.33
DPP4 P27487 2/20 0.33
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2D6 P10635 1/20 0.33
HRH1 P35367 1/20 0.33
MTOR P42345 1/20 0.33
RAB9A P51151 1/20 0.33
GRM7 Q14831 1/20 0.33
F2 P00734 1/20 0.33
MAOA P21397 1/20 0.32
MAOB P27338 1/20 0.32

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
SCHEMBL8975327 0.78 HTR2A (0.46) HTR2ATAAR1TSHRDPP4HRH1
SCHEMBL2979684 0.74 MAOA (0.34) HTR2ATAAR1SMN1; SMN2TSHRDPP4
SCHEMBL15195448 0.73 LMNA (0.52) SMN1; SMN2TSHRRAB9A
SCHEMBL29936912 0.73 TRPA1 (0.41) HTR2ATAAR1TSHRDPP4CYP1A2
SCHEMBL1120259 0.73 SCN4A (0.45) HTR2ATAAR1DPP4F2
SCHEMBL610027 0.73 LMNA (0.52) SMN1; SMN2TSHRRAB9A
SCHEMBL1129056 0.73 TAAR1 (0.52) TAAR1TSHRCYP1A2CYP3A4CYP2D6
SCHEMBL16426370 0.73 HTR2A (0.36) HTR2ATAAR1TSHRDPP4CYP1A2
SCHEMBL8535055 0.73 SCN4A (0.45) HTR2ATAAR1DPP4F2
SCHEMBL7590494 0.71 GSR (0.35) HTR2ATAAR1TSHRDPP4CYP1A2

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 HTR2A 1216/4885TAAR1 52/4885SMN1; SMN2 2630/4885

“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.