SCHEMBL5644232

SCHEMBL5644232

CC(C)(C)C(=O)N1CCN(c2ncc(Br)cn2)CC1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PANK3 Q9H999 1/20 0.51
NPC1 O15118 2/20 0.48
RAB9A P51151 2/20 0.48
CKS1B P61024 1/20 0.47
SKP1 P63208 1/20 0.47
SKP2 Q13309 1/20 0.47
TIPARP Q7Z3E1 1/20 0.44
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
IDE P14735 1/20 0.42
MAPT P10636 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.41
DCTPP1 Q9H773 1/20 0.41
TP53 P04637 1/20 0.40
SMO Q99835 1/20 0.40
LMNA P02545 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
HSD17B10 Q99714 1/20 0.40
ALDH1A1 P00352 1/20 0.40
HTT P42858 1/20 0.40

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
SCHEMBL1433484 0.82 PANK3 (0.54) PANK3NPC1RAB9ACKS1BSKP1
SCHEMBL712231 0.81 GPR119 (0.60) PANK3CKS1BSKP1SKP2MEN1
SCHEMBL18150026 0.81 PANK3 (0.48) PANK3RAB9ATIPARPL3MBTL1HSD17B10
SCHEMBL2825734 0.80 PANK3 (0.52) PANK3TIPARPMEN1KMT2AL3MBTL1
SCHEMBL15205453 0.76 GPR119 (0.56) PANK3CKS1BSKP1SKP2MEN1
SCHEMBL24312738 0.76 TDP1 (0.50) PANK3NPC1RAB9ACKS1BSKP1
SCHEMBL18149201 0.76 PPARG (0.53) PANK3TIPARPMAPTL3MBTL1HSD17B10
SCHEMBL1505703 0.75 PANK3 (0.41) PANK3NPC1RAB9ATIPARPMAPT
SCHEMBL15205772 0.74 PANK3 (0.47) PANK3TIPARPMEN1KMT2AL3MBTL1
SCHEMBL12820444 0.74 PANK3 (0.47) PANK3TIPARPMEN1KMT2AL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1307155-C Delta as pesticide1-pyrrolines BAYER CROPS SCIENCES GMBH (DE) 2007-03-28 CN disclosed
US-7179806-B2 Δ1-pyrrolines used as pesticides BAYER CROPSCIENCE AG (DE) 2007-02-20 US disclosed
US-7179806-B2 Δ1-pyrrolines used as pesticides BAYER CROPSCIENCE AG (DE) 2007-02-20 US disclosed
US-7179806-B2 Δ1-pyrrolines used as pesticides BAYER CROPSCIENCE AG (DE) 2007-02-20 US disclosed
EP-1347957-B1 DELTA 1-PYRROLINES USED AS PESTICIDES BAYER CROPSCIENCE AG (DE) 2005-09-07 EP disclosed
US-20040082586-A1 Delta 1-pyrrolines used as pesticides BAYER CROPSCIENCE AG (DE) 2004-04-29 US disclosed
CN-1487920-A Deltal-pyrrolines used as pesticides �ݶ�ũ�����ѧ�ɷݹ�˾ 2004-04-07 CN 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-20040082586-A1 Delta 1-pyrrolines used as pesticides DDT, CHRM1, PRMT1 PANK3 1941/4885NPC1 4379/4885RAB9A 357/4885

“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.