SCHEMBL15510656

SCHEMBL15510656

CC(C)COCCCN(C)C

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.39
TSHR P16473 1/20 0.39
KDM4E B2RXH2 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
SPHK1 Q9NYA1 2/20 0.36
SPHK2 Q9NRA0 1/20 0.36
HRH3 Q9Y5N1 3/20 0.34
DNM1 Q05193 3/20 0.33
LSS P48449 1/20 0.33
PIK3CD O00329 1/20 0.32
HTR1B P28222 1/20 0.32

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
SCHEMBL10081278 0.93 ALDH1A1 (0.43) ALDH1A1TSHRKDM4ESMN1; SMN2SPHK1
SCHEMBL14577269 0.85 CA12 (0.38) ALDH1A1TSHRKDM4ESMN1; SMN2SPHK1
SCHEMBL9629070 0.83 HTT (0.35) ALDH1A1TSHRKDM4ESMN1; SMN2SPHK1
SCHEMBL29651757 0.82 ALDH1A1 (0.36) ALDH1A1TSHRKDM4ESMN1; SMN2SPHK1
SCHEMBL29651760 0.82 ALDH1A1 (0.36) ALDH1A1TSHRKDM4ESMN1; SMN2SPHK1
SCHEMBL15182727 0.81 CA12 (0.44) ALDH1A1TSHRKDM4ESMN1; SMN2PIK3CD
SCHEMBL15510982 0.80 SPHK1 (0.37) SPHK1SPHK2PIK3CD
SCHEMBL13169202 0.80 ALDH1A1 (0.31) ALDH1A1TSHRKDM4ESMN1; SMN2SPHK1
SCHEMBL15182743 0.79 ALDH1A1 (0.38) ALDH1A1TSHRKDM4ESMN1; SMN2HRH3
SCHEMBL7527905 0.79 USP2 (0.44) ALDH1A1TSHRKDM4ESMN1; SMN2SPHK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11279735-B2 Cyclic peptide antibiotics GENENTECH, INC. (US) 2022-03-22 US disclosed
US-20200331968-A1 CYCLIC PEPTIDE ANTIBIOTICS GENENTECH, INC. (US) 2020-10-22 US disclosed
WO-2020185999-A1 CYCLIC PEPTIDE ANTIBIOTICS GENENTECH, INC. (US) 2020-09-17 WO disclosed
WO-2019052545-A1 CYCLIC PEPTIDE ANTIBIOTICS F. HOFFMANN-LA ROCHE AG (CH) 2019-03-21 WO disclosed
EP-2708529-B1 METHOD FOR MANUFACTURING PARTICLES SUMITOMO CHEMICAL CO (JP) 2018-04-04 EP disclosed
US-9796831-B2 Process for producing particles SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-10-24 US disclosed
CN-103974929-B The manufacture method of the halogen acid salt of haloalkylamine 住友化学株式会社 2016-08-24 CN disclosed
CN-103534236-B Method for producing granules 住友化学株式会社 2016-08-17 CN disclosed
CN-103974929-A Method for producing hydrohalic acid salt of halogenated alkyl amine SUMITOMO CHEMICAL CO 2014-08-06 CN disclosed
EP-2708529-A1 METHOD FOR MANUFACTURING PARTICLES Sumitomo Chemical Company Limited (JP) 2014-03-19 EP disclosed
US-20140065337-A1 PROCESS FOR PRODUCING PARTICLES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2014-03-06 US disclosed
CN-103534236-A Method for producing granules SUMITOMO CHEMICAL CO 2014-01-22 CN 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-20200331968-A1 CYCLIC PEPTIDE ANTIBIOTICS NPPA, LNPEP, CLPP ALDH1A1 4279/4885TSHR 2876/4885KDM4E 3065/4885
US-11279735-B2 Cyclic peptide antibiotics NPPA, LNPEP, CLPP ALDH1A1 4279/4885TSHR 2876/4885KDM4E 3065/4885

“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.