SCHEMBL1848739

SCHEMBL1848739

CN1CCCC1c1ccc(NN)nc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.52
CHRNA7 P36544 2/20 0.52
CHRNB2 P17787 2/20 0.52
CHRNB4 P30926 2/20 0.52
CHRNA3 P32297 2/20 0.52
CHRNA4 P43681 2/20 0.52
CHRNA2 Q15822 2/20 0.52
LMNA P02545 1/20 0.52
TDP1 Q9NUW8 1/20 0.52
HTR3E A5X5Y0 1/20 0.52
PSIP1 O75475 1/20 0.52
TRPA1 O75762 1/20 0.52
HTR3B O95264 1/20 0.52
CHRNA1 P02708 1/20 0.52
CHRNG P07510 1/20 0.52
MAPT P10636 1/20 0.52
CHRNB1 P11230 1/20 0.52
CYP2A6 P11509 1/20 0.52
PTGS1 P23219 1/20 0.52
CHRNA5 P30532 1/20 0.52

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
SCHEMBL1848736 1.00 ALDH1A1 (0.52) ALDH1A1CHRNA7CHRNB2CHRNB4CHRNA3
SCHEMBL29398395 1.00 ALDH1A1 (0.52) ALDH1A1CHRNA7CHRNB2CHRNB4CHRNA3
SCHEMBL524734 0.80 ALDH1A1 (0.56) ALDH1A1CHRNA7CHRNB2CHRNB4CHRNA3
SCHEMBL523445 0.80 ALDH1A1 (0.56) ALDH1A1CHRNA7CHRNB2CHRNB4CHRNA3
SCHEMBL29766108 0.80 ALDH1A1 (0.64) ALDH1A1CHRNA7CHRNB2CHRNB4CHRNA3
SCHEMBL30618802 0.80 ALDH1A1 (0.64) ALDH1A1CHRNA7CHRNB2CHRNB4CHRNA3
SCHEMBL9366878 0.79 PTGS1 (0.52) PTGS1
SCHEMBL29173751 0.78 CHRNA7 (0.62) ALDH1A1CHRNA7CHRNB2CHRNB4CHRNA3
SCHEMBL5249340 0.78 CHRNA7 (0.62) ALDH1A1CHRNA7CHRNB2CHRNB4CHRNA3
SCHEMBL30866542 0.78 CHRNA7 (0.62) ALDH1A1CHRNA7CHRNB2CHRNB4CHRNA3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9718929-B2 Chelating amphiphilic polymers KONINKLIJKE PHILIPS N.V. (NL) 2017-08-01 US disclosed
CN-102149371-B Chelating amphiphilic polymers 皇家飞利浦电子股份有限公司 2017-04-19 CN disclosed
US-20150247008-A1 CHELATING AMPHIPHILIC POLYMERS KONINKL PHILIPS NV (NL) 2015-09-03 US disclosed
EP-2323636-B1 CHELATING AMPHIPHILIC POLYMERS KONINKL PHILIPS NV (NL) 2015-08-12 EP disclosed
US-9034298-B2 Chelating amphiphilic polymers KONINKLIJKE PHILIPS N.V. (NL) 2015-05-19 US disclosed
CN-102149371-A Chelating amphiphilic polymers KONINKL PHILIPS ELECTRONICS NV 2011-08-10 CN disclosed
US-20110165074-A1 CHELATING AMPHIPHILIC POLYMERS KONINKLIJKE PHILIPS ELECTRONICS N.V. (NL) 2011-07-07 US disclosed
EP-2323636-A1 CHELATING AMPHIPHILIC POLYMERS Koninklijke Philips Electronics N.V. (NL) 2011-05-25 EP disclosed
WO-2010029500-A1 CHELATING AMPHIPHILIC POLYMERS KONINKLIJKE PHILIPS ELECTRONICS N.V. (NL) 2010-03-18 WO disclosed
EP-2161020-A1 Chelating amphiphilic polymers Koninklijke Philips Electronics N.V. (NL) 2010-03-10 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 (2 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-20150247008-A1 CHELATING AMPHIPHILIC POLYMERS SLC30A5, SLC30A6, ABCB4 ALDH1A1 4768/4885CHRNA7 3618/4885CHRNB2 2880/4885
US-20110165074-A1 CHELATING AMPHIPHILIC POLYMERS SLC30A5, PICALM, SLC30A6 ALDH1A1 4789/4885CHRNA7 3586/4885CHRNB2 3082/4885

“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.