SCHEMBL3759947

SCHEMBL3759947

C=CC(N)OCCCCC

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 1/20 0.45
ALDH1A1 P00352 1/20 0.37
CNR1 P21554 1/20 0.37
CNR2 P34972 1/20 0.37
OPRM1 P35372 1/20 0.34
TSHR P16473 1/20 0.34
CA1 P00915 9/20 0.34
CA2 P00918 9/20 0.34
CA9 Q16790 8/20 0.34
CA12 O43570 3/20 0.33
CA7 P43166 3/20 0.33
CA14 Q9ULX7 3/20 0.33
CA3 P07451 2/20 0.33
CA4 P22748 2/20 0.33
CA6 P23280 2/20 0.33
CA5A P35218 2/20 0.33
CA5B Q9Y2D0 2/20 0.33
HTT P42858 1/20 0.33

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
SCHEMBL3804432 0.84
SCHEMBL9739299 0.80 DNM1 (0.47) DNM1ALDH1A1CNR1CNR2OPRM1
SCHEMBL10071572 0.77 DNM1 (0.43) DNM1ALDH1A1CNR1CNR2TSHR
Hydrochloric Acid SCHEMBL9277599 0.77 DNM1 (0.39) DNM1ALDH1A1CNR1CNR2TSHR
SCHEMBL19792764 0.76 DNM1 (0.47) DNM1ALDH1A1CNR1CNR2TSHR
SCHEMBL1378620 0.76 DNM1 (0.42) DNM1ALDH1A1CNR1CNR2TSHR
SCHEMBL2623215 0.76 DNM1 (0.47) DNM1ALDH1A1CNR1CNR2TSHR
SCHEMBL11010126 0.76 DNM1 (0.47) DNM1ALDH1A1CNR1CNR2TSHR
SCHEMBL10071568 0.76 DNM1 (0.47) DNM1ALDH1A1CNR1CNR2TSHR
SCHEMBL8081463 0.75

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 30 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105517991-B Aryloxyalkylamine derivative, pharmaceutical composition and pharmaceutical application thereof 奥斯瓦道·克鲁兹基金会 2019-06-07 CN claimed
CN-108912005-A Two phenoxy group alkylamine derivatives and its pharmaceutical composition 奥斯瓦道·克鲁兹基金会 2018-11-30 CN claimed
CN-105517991-B Aryloxyalkylamine derivative, pharmaceutical composition and pharmaceutical application thereof 奥斯瓦道·克鲁兹基金会 2019-06-07 CN disclosed
CN-105517991-B Aryloxyalkylamine derivative, pharmaceutical composition and pharmaceutical application thereof 奥斯瓦道·克鲁兹基金会 2019-06-07 CN disclosed
CN-105517991-B Aryloxyalkylamine derivative, pharmaceutical composition and pharmaceutical application thereof 奥斯瓦道·克鲁兹基金会 2019-06-07 CN disclosed
CN-108912005-A Two phenoxy group alkylamine derivatives and its pharmaceutical composition 奥斯瓦道·克鲁兹基金会 2018-11-30 CN disclosed
CN-108912005-A Two phenoxy group alkylamine derivatives and its pharmaceutical composition 奥斯瓦道·克鲁兹基金会 2018-11-30 CN disclosed
CN-105712977-A CYCLOALKYLOXY- AND HETEROCYCLOALKYLOXYPYRIDINE COMPOUNDS AS MODULATORS OF THE HISTAMINE H3 RECEPTOR 詹森药业有限公司 2016-06-29 CN disclosed
US-9320752-B2 Pesticidal ear tag Y-TEX CORPORATION (US) 2016-04-26 US disclosed
CN-105517991-A Diphenyloxyalkylamine derivatives and aryloxyalkylamine derivatives, pharmaceutical compositions, use of said pharmaceutical compositions for treating, preventing or inhibiting chronic pulmonary inflammatory diseases and methods for treating or preventing said diseases FUNDACAO OSWALDO CRUZ 2016-04-20 CN disclosed
US-20130273134-A1 PESTICIDAL EAR TAG Y-TEX CORPORATION 2013-10-17 US disclosed
WO-2004113305-A2 DIAMINO SUBSTITUTED QUINAZOLINE DERIVATIVES AS PROMOTERS OF SMN2 VERTEX PHARMACEUTICALS INCORPORATED (US) 2004-12-29 WO disclosed
EP-0969065-B1 Die attach adhesives for use in microelectronic NAT STARCH CHEM INVEST (US) 2004-10-06 EP disclosed
CN-1468227-A Non-imidazole aryloxyalkylamines ����-������ҩƷ��˾ 2004-01-14 CN disclosed
US-6355750-B1 CURABLE ADHESIVE COMPRISING SILOXANE-CONTAINING MALEIMIDE COMPOUND AND FREE RADICAL- OR PHOTOINITIATOR; SEMICONDUCTORS, INTEGRATED CIRCUITS NATIONAL STARCH AND CHEMICAL INVESTMENT HOLDING CORPORATION 2002-03-12 US disclosed
US-20020007042-A1 Die attach adhesives for use in microelectronic devices NATIONAL STARCH AND CHEMICAL INVESTMENT HOLDING CORPORATION 2002-01-17 US disclosed
EP-1146065-A1 Die attach adhesives for use in microelectronic devices National Starch and Chemical Investment Holding Corporation (US) 2001-10-17 EP disclosed
US-6265530-B1 CURABLE ADHESIVE COMPOSITION FOR BONDING ELECTRONIC COMPONENT TO SUBSTRATE COMPRISING MALEIMIDE COMPOUND AND CURING INITIATOR SELECTED FROM GROUP CONSISTING OF FREE RADICAL INITIATOR, PHOTOINITIATOR AND COMBINATION THEREOF NATIONAL STARCH AND CHEMICAL INVESTMENT HOLDING CORPORATION 2001-07-24 US disclosed
EP-0969065-A2 Die attach adhesives for use in microelectronic National Starch and Chemical Investment Holding Corporation (US) 2000-01-05 EP disclosed
WO-1990010628-A1 NOVEL ARYLOXY ALKYL AMINES, THEIR PRODUCTION AND MEDICAMENTS CONTAINING THEM LAEVOSAN-GESELLSCHAFT MBH (AT) 1990-09-20 WO 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-20130273134-A1 PESTICIDAL EAR TAG ABAT, AADAC, BRDT DNM1 856/4885ALDH1A1 1223/4885CNR1 3640/4885

“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.