SCHEMBL930197

SCHEMBL930197

CN(C)CCCc1ncncn1

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 4/20 0.39
HRH4 Q9H3N8 2/20 0.39
NOS3 P29474 3/20 0.37
NOS1 P29475 3/20 0.37
NOS2 P35228 2/20 0.37
ALDH1A1 P00352 3/20 0.36
TSHR P16473 1/20 0.36
SIGMAR1 Q99720 1/20 0.35
KDM4E B2RXH2 2/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
CHRNA7 P36544 1/20 0.33
SLC6A4 P31645 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
SCHEMBL7522556 0.75 HSP90AA1 (0.32)
SCHEMBL1864672 0.75 HRH3 (0.39) HRH3NOS2ALDH1A1TSHRKDM4E
SCHEMBL5718810 0.74 ALDH1A1 (0.45) HRH3HRH4NOS3NOS1NOS2
SCHEMBL306173 0.73 TDP1 (0.39) HRH3ALDH1A1KDM4ESMN1; SMN2SLC6A4
SCHEMBL29066337 0.72 ALDH1A1 (0.43) HRH3HRH4NOS3NOS1NOS2
SCHEMBL28254738 0.71 KCNH2 (0.42) ALDH1A1TSHRKDM4ESMN1; SMN2SLC6A4
SCHEMBL27794520 0.71 KCNH2 (0.42) ALDH1A1TSHRKDM4ESMN1; SMN2SLC6A4
SCHEMBL20499801 0.71 KCNH2 (0.42) ALDH1A1TSHRKDM4ESMN1; SMN2SLC6A4
SCHEMBL20747030 0.71 KCNH2 (0.42) ALDH1A1TSHRKDM4ESMN1; SMN2SLC6A4
SCHEMBL2708603 0.71 KCNH2 (0.42) ALDH1A1TSHRKDM4ESMN1; SMN2SLC6A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107743502-A Solidification composition filling 爱客多有限公司 2018-02-27 CN claimed
US-20170306096-A1 MOISTURE CURABLE COMPOSITIONS MOMENTIVE PERFORMANCE MATERIALS INC. 2017-10-26 US claimed
EP-3221374-A1 MOISTURE CURABLE COMPOSITIONS Momentive Performance Materials Inc. (US) 2017-09-27 EP claimed
WO-2016185209-A1 CURING COMPOSITIONS AQDOT LIMITED (GB) 2016-11-24 WO claimed
WO-2016081790-A1 MOISTURE CURABLE COMPOSITIONS MOMENTIVE PERFORMANCE MATERIALS INC. (US) 2016-05-26 WO claimed
EP-2106415-B1 TERTIARY AMINES BLOCKED WITH POLYMER ACIDS HUNTSMAN PETROCHEMICAL LLC (US) 2016-04-20 EP claimed
US-20150094387-A1 Use of Thickening Agents as Polyurethane Amine Catalyst Diluents HUNTSMAN PETROCHEMICAL LLC (US) 2015-04-02 US claimed
EP-2742078-A1 USE OF THICKENING AGENTS AS POLYURETHANE AMINE CATALYST DILUENTS Huntsman Petrochemical LLC (US) 2014-06-18 EP claimed
CN-103732645-A Use of thickeners as polyurethane amine catalyst diluents HUNTSMAN PETROCHEMICAL LLC 2014-04-16 CN claimed
WO-2013023125-A1 USE OF THICKENING AGENTS AS POLYURETHANE AMINE CATALYST DILUENTS HUNTSMAN PETROCHEMICAL LLC (US) 2013-02-14 WO claimed
US-20100099785-A1 TERTIARY AMINES BLOCKED WITH POLYMER ACIDS HUNTSMAN PETROCHEMICAL CORPORATION (US) 2010-04-22 US claimed
CN-101631811-A Polymer-terminated tertiary amines HUNTSMAN SPEC CHEM CORP 2010-01-20 CN claimed
EP-2106415-A1 TERTIARY AMINES BLOCKED WITH POLYMER ACIDS Huntsman Petrochemical Corporation (US) 2009-10-07 EP claimed
WO-2008089411-A1 TERTIARY AMINES BLOCKED WITH POLYMER ACIDS HUNTSMAN PETROCHEMICAL CORPORATION (US) 2008-07-24 WO claimed
US-5294647-A Polyurethane insulation ATLAS ROOFING CORPORATION (US) 1994-03-15 US claimed
EP-3768759-A1 EXTENDED POT-LIFE FOR LOW TEMPERATURE CURING POLYURETDIONE RESINS Covestro LLC (US) 2021-01-27 EP disclosed
US-10633477-B2 Extended pot-life for low temperature curing polyuretdione resins COVESTRO LLC (US) 2020-04-28 US disclosed
US-5449700-A Polyetherurethane copolymers which may contain amines or polyamines MILES INC. (US) 1995-09-12 US disclosed
US-4425446-A INSULATING FOAM SEALED AIR CORPORATION (US) 1984-01-10 US disclosed
US-4401769-A SOFTENERS, POLYISOCYANURATES, POLYCARBODIMIDES SEALED AIR CORPORATION (US) 1983-08-30 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-20170306096-A1 MOISTURE CURABLE COMPOSITIONS DOT1L, EHMT2, CDH1 HRH3 99/4885HRH4 292/4885NOS3 219/4885

“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.