SCHEMBL3467156

SCHEMBL3467156

C=CCN(CC)C1CCCCC1

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ADH1A P07327 6/20 0.44
ADH1C P00326 4/20 0.44
ALDH1A1 P00352 5/20 0.41
SIGMAR1 Q99720 2/20 0.40
TMEM97 Q5BJF2 1/20 0.40
EBP Q15125 1/20 0.40
SMN1; SMN2 Q16637 2/20 0.33
KDM4E B2RXH2 2/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
ADH1B P00325 1/20 0.31
HPGD P15428 1/20 0.31
LMNA P02545 1/20 0.31

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
SCHEMBL30750 0.87 ALDH1A1 (0.41) ADH1AADH1CALDH1A1SIGMAR1KDM4E
Ammonia Solution, Strong SCHEMBL17439397 0.85 ALDH1A1 (0.40) ADH1AADH1CALDH1A1SIGMAR1KDM4E
Hydrochloric Acid SCHEMBL2957420 0.85 ALDH1A1 (0.40) ADH1AADH1CALDH1A1SIGMAR1KDM4E
Fluoride SCHEMBL9620616 0.85 ALDH1A1 (0.40) ADH1AADH1CALDH1A1SIGMAR1KDM4E
SCHEMBL2163192 0.84 ALDH1A1 (0.38) ADH1AADH1CALDH1A1SIGMAR1
SCHEMBL3429552 0.84 ADH1A (0.47) ADH1AADH1CALDH1A1LMNA
SCHEMBL10582372 0.83 ALDH1A1 (0.39) ADH1AADH1CALDH1A1
SCHEMBL29957210 0.81 ADH1A (0.55) ADH1AADH1CALDH1A1SIGMAR1TMEM97
SCHEMBL737248 0.80 ADH1A (0.43) ADH1AADH1CALDH1A1SIGMAR1TMEM97
SCHEMBL12473169 0.80 SHBG (0.32) SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2827415-A1 POLYMER ELECTROLYTE MEMBRANE HAVING GRAFT CHAIN, AND PRODUCTION METHOD THEREFOR Nitto Denko Corporation (JP) 2015-01-21 EP claimed
US-20150010848-A1 POLYMER ELECTROLYTE MEMBRANE HAVING GRAFT CHAINS, AND METHOD FOR PRODUCING THE SAME NITTO DENKO CORPORATION (JP) 2015-01-08 US claimed
CN-104170137-A Polymer electrolyte membrane having graft chain, and production method therefor NITTO DENKO CORP 2014-11-26 CN claimed
US-20200332131-A1 FLAME RETARDANT AID, FLAME RETARDING AGENT COMPOSITION, AND METHOD FOR PRODUCING FLAME-RETARDANT FIBER FABRIC NICCA CHEMICAL CO., LTD. (JP) 2020-10-22 US disclosed
EP-2827415-A1 POLYMER ELECTROLYTE MEMBRANE HAVING GRAFT CHAIN, AND PRODUCTION METHOD THEREFOR Nitto Denko Corporation (JP) 2015-01-21 EP disclosed
US-20150010848-A1 POLYMER ELECTROLYTE MEMBRANE HAVING GRAFT CHAINS, AND METHOD FOR PRODUCING THE SAME NITTO DENKO CORPORATION (JP) 2015-01-08 US disclosed
CN-104170137-A Polymer electrolyte membrane having graft chain, and production method therefor NITTO DENKO CORP 2014-11-26 CN disclosed
EP-2199265-B1 GLASS FIBER SIZING AGENT CONTAINING AMPHOTERIC POLYMER COMPOUND NITTO BOSEKI CO LTD (JP) 2012-11-07 EP disclosed
CN-101687698-B Glass fiber sizing agent containing amphoteric polymer compound NITTO BOSEKI CO LTD 2012-08-01 CN disclosed
US-20100215940-A1 Glass Fiber Sizing Agent Containing Amphoteric Polymer Compound NITTO BOSEKI CO., LTD. (JP) 2010-08-26 US disclosed
EP-2199265-A1 GLASS FIBER SIZING AGENT CONTAINING AMPHOTERIC POLYMER COMPOUND Nitto Boseki CO., LTD. (JP) 2010-06-23 EP disclosed
CN-101687698-A Glass fiber sizing agent containing amphoteric polymer compound NITTO BOSEKI CO LTD 2010-03-31 CN disclosed
US-7326703-B2 (1,10B-Dihydro-2-(aminocarbonyl-phenyl)-5H-pyrazolo[1,5-c][1,3]benzoxazin-5-yl)phenyl methanone derivatives as HIV viral replication inhibitors TIBOTEC PHARMACEUTICALS LTD (IL) 2008-02-05 US disclosed
US-20070248624-A1 (1,10B-Dihydro-2-(Aminocarbonyl-Phenyl)-5h-Pyrazolo[1,5-C][1,3]Benzoxazin-5-Yl)Phenyl Methanone Derivatives as Hiv Viral Replication Inhibitors JANSSEN SCIENCES IRELAND UC (IE) 2007-10-25 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-20070248624-A1 (1,10B-Dihydro-2-(Aminocarbonyl-Phenyl)-5h-Pyrazolo[1,5-C][1,3]Benzoxazin-5-Yl)Phenyl Methanone Derivatives as Hiv Viral Replication Inhibitors POLRMT, MAVS, DHX15 ADH1A 919/4885ADH1C 401/4885ALDH1A1 789/4885

“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.