SCHEMBL2114688

SCHEMBL2114688

CCCCCN[C@H](C)C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.49
EPHX1 P07099 7/20 0.46
FAAH O00519 3/20 0.45
SLC6A5 Q9Y345 1/20 0.42
ACE2 Q9BYF1 1/20 0.42
FNTA P49354 1/20 0.42
FNTB P49356 1/20 0.42
GPR84 Q9NQS5 3/20 0.42
FFAR1 O14842 1/20 0.42
MAPT P10636 1/20 0.41

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
SCHEMBL171001 1.00 SMN1; SMN2 (0.49) SMN1; SMN2EPHX1FAAHSLC6A5ACE2
SCHEMBL171002 1.00 SMN1; SMN2 (0.49) SMN1; SMN2EPHX1FAAHSLC6A5ACE2
SCHEMBL8436544 0.98 EPHX1 (0.48) SMN1; SMN2EPHX1FAAHACE2FNTA
SCHEMBL148701 0.98 EPHX1 (0.48) SMN1; SMN2EPHX1FAAHACE2FNTA
SCHEMBL993588 0.98 EPHX1 (0.48) SMN1; SMN2EPHX1FAAHACE2FNTA
SCHEMBL352163 0.98 EPHX1 (0.48) SMN1; SMN2EPHX1FAAHACE2FNTA
SCHEMBL6758775 0.98 EPHX1 (0.48) SMN1; SMN2EPHX1FAAHACE2FNTA
SCHEMBL10579468 0.98 EPHX1 (0.48) SMN1; SMN2EPHX1FAAHACE2FNTA
SCHEMBL22325587 0.98 EPHX1 (0.48) SMN1; SMN2EPHX1FAAHACE2FNTA
SCHEMBL9436902 0.98 EPHX1 (0.48) SMN1; SMN2EPHX1FAAHACE2FNTA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024054892-A1 THERAPEUTIC PEPTIDES SHAPE THERAPEUTICS INC. (US) 2024-03-14 WO claimed
WO-2024054892-A1 THERAPEUTIC PEPTIDES SHAPE THERAPEUTICS INC. (US) 2024-03-14 WO disclosed
US-20120093746-A1 AMINO ACID-MODIFIED ORGANOPOLYSILOXANE, MAKING METHOD, AND COSMETICS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2012-04-19 US disclosed
US-7368424-B2 Acylated nonadepsipeptides AICURIS GMBH & CO. KG (DE) 2008-05-06 US disclosed
WO-2007001335-A2 RAMOPLANIN DERIVATIVES POSSESSING ANTIBACTERIAL ACTIVITY VICURON PHARMACEUTICALS INC. (US) 2007-01-04 WO disclosed
US-20060211603-A1 Ramoplanin derivatives possessing antibacterial activity VICURON PHARMACEUTICALS INC. (US) 2006-09-21 US disclosed
US-20050075281-A1 peptide antibiotics comprising lysobactin derivatives used for treatment and/or prophylaxis of bacterial infectious diseases; cyclic peptides BAYER HEALTHCARE AG (DE) 2005-04-07 US disclosed
EP-0805674-A1 SKIN AND HAIR COSMETIC COMPOSITIONS Kao Corporation (JP) 1997-11-12 EP disclosed
WO-1997014401-A1 SKIN AND HAIR COSMETIC COMPOSITIONS KAO CORPORATION (JP) 1997-04-24 WO 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 (3 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-20120093746-A1 AMINO ACID-MODIFIED ORGANOPOLYSILOXANE, MAKING METHOD, AND COSMETICS DAO, AADAT, BCAT2 SMN1; SMN2 724/4885EPHX1 2853/4885FAAH 2162/4885
US-20050075281-A1 peptide antibiotics comprising lysobactin derivatives used for treatment and/or prophylaxis of bacterial infectious diseases; cyclic peptides VIP, LNPEP, HAMP SMN1; SMN2 4444/4885EPHX1 4613/4885FAAH 3901/4885
US-20060211603-A1 Ramoplanin derivatives possessing antibacterial activity CLSPN, LMAN2, RPN2 SMN1; SMN2 3894/4885EPHX1 4190/4885FAAH 3814/4885

“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.