SCHEMBL8614030

SCHEMBL8614030

OCCCCCOC1CCCCC1

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.45
NAAA Q02083 3/20 0.38
EPHX1 P07099 1/20 0.37
PRKCA P17252 1/20 0.33
ALDH1A1 P00352 5/20 0.33
SPHK1 Q9NYA1 1/20 0.33
GAA P10253 1/20 0.32
RECQL P46063 2/20 0.32
KMT2A Q03164 2/20 0.32
RAB9A P51151 1/20 0.32
MEN1 O00255 1/20 0.30
THRB P10828 1/20 0.30
HTT P42858 1/20 0.30

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
SCHEMBL1901243 1.00 NPC1 (0.45) NPC1NAAAEPHX1PRKCAALDH1A1
SCHEMBL1258617 0.98 NPC1 (0.47) NPC1NAAAEPHX1PRKCAALDH1A1
SCHEMBL3752919 0.96 NPC1 (0.43) NPC1NAAAEPHX1PRKCAALDH1A1
Bicarbonate SCHEMBL10534241 0.92 NAAA (0.40) NPC1NAAAEPHX1PRKCAALDH1A1
SCHEMBL22124333 0.91 NPC1 (0.39) NPC1NAAASPHK1GAA
SCHEMBL3345126 0.91 NPC1 (0.48) NPC1NAAAEPHX1
SCHEMBL386704 0.91 NPC1 (0.48) NPC1NAAAEPHX1
SCHEMBL10684492 0.89 GAA (0.35) NPC1ALDH1A1SPHK1GAAKMT2A
SCHEMBL1444884 0.89 NPC1 (0.45) NPC1NAAAALDH1A1
SCHEMBL10687104 0.89 GAA (0.35) NPC1ALDH1A1SPHK1GAAKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11912699-B2 Tau-protein targeting compounds and associated ARVINAS OPERATIONS, INC. (US) 2024-02-27 US disclosed
US-20180125821-A1 TAU-PROTEIN TARGETING PROTACS AND ASSOCIATED METHODS OF USE ARVINAS OPERATIONS, INC. 2018-05-10 US disclosed
EP-0726254-B1 Quinoline-4-carbonylguanidine derivates, process for producing the same and pharmaceutical preparations containing the compounds MITSUI TOATSU CHEMICALS (JP) 1998-05-06 EP disclosed
US-5627193-A MEDICAL DIAGNOSIS, CARDIOVASCULAR DIAORDERS AND PROTECTION OF ORGANS FOR TRANSPLANTATION MITSUI TOATSU CHEMICALS, INC. (JP) 1997-05-06 US disclosed
EP-0726254-A1 Quinoline-4-carbonylguanidine derivates, process for producing the same and pharmaceutical preparations containing the compounds MITSUI TOATSU CHEMICALS, Inc. (JP) 1996-08-14 EP disclosed
EP-0467290-B1 Alpha-(alkylcyclohexyloxy)-beta-alkanols and perfume compositions containing the same KAO CORP (JP) 1995-10-11 EP disclosed
US-4767883-A PHOTORESISTS; FLEXIBILITY; LOW VISCOSITY, HIGH GLASS TRANSITION TEMPERATURE; CROSSLINKABLE EASTMAN KODAK COMPANY (US) 1988-08-30 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 (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-11912699-B2 Tau-protein targeting compounds and associated MAPT, VHL, CRBN NPC1 2550/4885NAAA 4529/4885EPHX1 3738/4885
US-20180125821-A1 TAU-PROTEIN TARGETING PROTACS AND ASSOCIATED METHODS OF USE CRBN, VHL, UBQLN2 NPC1 3216/4885NAAA 4503/4885EPHX1 3826/4885

“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.