SCHEMBL4279720

SCHEMBL4279720

C[n+]1ccn(CC(C)(C)C)c1

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
FDPS P14324 2/20 0.49
SMN1; SMN2 Q16637 2/20 0.46
MEN1 O00255 1/20 0.46
APAF1 O14727 1/20 0.46
NPC1 O15118 1/20 0.46
PLA2G1B P04054 1/20 0.46
HSP90AA1 P07900 1/20 0.46
MAPT P10636 1/20 0.46
MAPK1 P28482 1/20 0.46
HTT P42858 1/20 0.46
RAB9A P51151 1/20 0.46
KMT2A Q03164 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
ATG4B Q9Y4P1 1/20 0.46
LMNA P02545 1/20 0.37
PON1 P27169 2/20 0.34

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
SCHEMBL13780862 0.86 FDPS (0.49) FDPSSMN1; SMN2MEN1APAF1NPC1
SCHEMBL425219 0.80 FDPS (0.47) FDPSSMN1; SMN2MEN1APAF1NPC1
SCHEMBL15136817 0.75 SMN1; SMN2 (0.63) FDPSSMN1; SMN2MEN1APAF1NPC1
SCHEMBL988007 0.75 SMN1; SMN2 (0.52) FDPSSMN1; SMN2MEN1APAF1NPC1
SCHEMBL12558413 0.75 SMN1; SMN2 (0.58) FDPSSMN1; SMN2MEN1APAF1NPC1
Water SCHEMBL17764770 0.73 SMN1; SMN2 (0.61) FDPSSMN1; SMN2MEN1APAF1NPC1
Hydrochloric Acid SCHEMBL4417695 0.73 SMN1; SMN2 (0.50) FDPSSMN1; SMN2MEN1APAF1NPC1
Iodide SCHEMBL4414352 0.73 SMN1; SMN2 (0.50) FDPSSMN1; SMN2MEN1APAF1NPC1
Bromide SCHEMBL4416367 0.73 SMN1; SMN2 (0.55) FDPSSMN1; SMN2MEN1APAF1NPC1
SCHEMBL34729 0.73

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9650494-B2 Polymer nanocomposites and methods of making nanocomposites KING ABDULLAH UNIVERSITY OF SCIENCE AND TECHNOLOGY (SA) 2017-05-16 US claimed
US-20140128519-A1 POLYMER NANOCOMPOSITES AND METHODS OF MAKING NANOCOMPOSITES SAUDI ARABIAN OIL COMPANY (SA) 2014-05-08 US claimed
US-9815001-B2 Use of a fiber conduit contactor for extraction Chemtor, LP. (US) 2017-11-14 US disclosed
US-9650494-B2 Polymer nanocomposites and methods of making nanocomposites KING ABDULLAH UNIVERSITY OF SCIENCE AND TECHNOLOGY (SA) 2017-05-16 US disclosed
US-20170014733-A1 Use Of A Fiber Conduit Contactor For Extraction MASSINGILL, DR. JOHN 2017-01-19 US disclosed
US-9468866-B2 Use of a fiber conduit contactor for metal and/or metalloid extraction CHEMTOR, LP (US) 2016-10-18 US disclosed
US-20150315618-A1 Enzymatic Chemical Processing in a Fiber Conduit Apparatus MASSINGILL, DR. JOHN 2015-11-05 US disclosed
WO-2014100454-A1 ENZYMATIC CHEMICAL PROCESSING IN A FIBER CONDUIT APPARATUS MASSINGILL JOHN LEE (US) 2014-06-26 WO disclosed
US-20140128519-A1 POLYMER NANOCOMPOSITES AND METHODS OF MAKING NANOCOMPOSITES SAUDI ARABIAN OIL COMPANY (SA) 2014-05-08 US disclosed
WO-2014047195-A1 USE OF A FIBER CONDUIT CONTACTOR FOR METAL AND/OR METALLOID EXTRACTION CHEMTOR, LP (US) 2014-03-27 WO disclosed
US-20140076805-A1 Use of a Fiber Conduit Contactor for Metal and/or Metalloid Extraction CHEMTOR, LP (US) 2014-03-20 US disclosed
US-7615644-B2 catalytic producing methanol from methane gas, by bubbling methane through the oxidation catalyst liquid mixture containing an imidazolium ionic liquid catalyst and a dissolved platinum compound as PtCl2, PtCl4, PtO2; cost efficiency, energy efficiency, low pollution, environmentally friendly CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2009-11-10 US disclosed
US-20060069169-A1 Use of ionic liquids as coordination ligands for organometallic catalysts CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2006-03-30 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-20170014733-A1 Use Of A Fiber Conduit Contactor For Extraction SORD, NEFM, FGF2 FDPS 508/4885SMN1; SMN2 2480/4885MEN1 2086/4885

“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.