SCHEMBL3225876

SCHEMBL3225876

CCC[CH]Oc1cnc(Cl)c(Cl)c1

nearest known ligand 0.47

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.38
NPSR1 Q6W5P4 2/20 0.38
CHRNB2 P17787 1/20 0.37
CHRNA4 P43681 1/20 0.37
LMNA P02545 1/20 0.35
POLB P06746 1/20 0.35

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
SCHEMBL15918589 0.75 CHRNB2 (0.43) ALDH1A1NPSR1CHRNB2CHRNA4LMNA
SCHEMBL15918740 0.74 ALDH1A1 (0.50) ALDH1A1NPSR1CHRNB2CHRNA4LMNA
SCHEMBL27291555 0.74 NPC1 (0.47) ALDH1A1NPSR1CHRNB2CHRNA4LMNA
SCHEMBL12225596 0.73 CHRNB2 (0.38) ALDH1A1NPSR1CHRNB2CHRNA4LMNA
SCHEMBL6499085 0.72 THRB (0.43) ALDH1A1NPSR1CHRNB2CHRNA4
SCHEMBL3356087 0.71 ALOX5 (0.36) LMNA
SCHEMBL5942319 0.70 CHRNB2 (0.41) ALDH1A1NPSR1CHRNB2CHRNA4
SCHEMBL14720949 0.67 CHRNB2 (0.45) CHRNB2CHRNA4
SCHEMBL2889463 0.67 CHRNB2 (0.42) CHRNB2CHRNA4POLB
SCHEMBL1547204 0.66 MAP4K4 (0.41) ALDH1A1NPSR1CHRNB2CHRNA4

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 ALDH1A1 1958/4885NPSR1 273/4885CHRNB2 169/4885

“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.