SCHEMBL3841704

SCHEMBL3841704

COCCOCCOCCOCCOCCOC(=O)N[C@@H](CC(C)C)C(=O)ON1C(=O)CCC1=O

nearest known ligand 0.44

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ CAPN1 P07384 5/20 0.44
▸ TAS1R3 Q7RTX0 10/20 0.36
▸ TAS1R1 Q7RTX1 10/20 0.36
▸ TYR P14679 1/20 0.35
▸ POLB P06746 1/20 0.35
▸ CTSK P43235 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
SCHEMBL3841812 1.00 CAPN1 (0.44) CAPN1TAS1R3TAS1R1TYRPOLB
SCHEMBL3840752 1.00 CAPN1 (0.44) CAPN1TAS1R3TAS1R1TYRPOLB
SCHEMBL3842586 1.00 CAPN1 (0.44) CAPN1TAS1R3TAS1R1TYRPOLB
SCHEMBL3840104 0.96 CAPN1 (0.41) CAPN1TAS1R3TAS1R1TYRPOLB
SCHEMBL16214295 0.87 CAPN1 (0.38) CAPN1
SCHEMBL4391955 0.85 TYR (0.37) CAPN1TAS1R3TAS1R1TYRPOLB
SCHEMBL4541619 0.83 CTSK (0.37) TYRPOLBCTSK
SCHEMBL5880046 0.83 TAS1R3 (0.39) TAS1R3TAS1R1TYRCTSK
SCHEMBL12990568 0.82 HPGD (0.35) CAPN1POLB
SCHEMBL10600585 0.81 ALDH1A1 (0.49) TAS1R3TAS1R1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3466421-A1 COMPOSITION FOR TREATMENT AND/OR PREVENTION OF PERIPHERAL NERVE DISORDER Osaka City University (JP) 2019-04-10 — — EP disclosed
EP-2647386-B1 LISSENCEPHALY THERAPEUTIC AGENT UNIV OSAKA CITY (JP) 2018-09-05 — — EP disclosed
US-9539298-B2 Lissencephaly therapeutic agent OSAKA CITY UNIVERSITY (JP) 2017-01-10 — — US disclosed
US-20160250276-A1 LISSENCEPHALY THERAPEUTIC AGENT OSAKA CITY UNIVERSITY (JP) 2016-09-01 — — US disclosed
US-9371359-B2 Lissencephaly therapeutic agent OSAKA CITY UNIVERSITY (JP) 2016-06-21 — — US disclosed
EP-2647386-A1 LISSENCEPHALY THERAPEUTIC AGENT Osaka City University (JP) 2013-10-09 — — EP disclosed
US-20130244945-A1 LISSENCEPHALY THERAPEUTIC AGENT OSAKA CITY UNIVERSITY 2013-09-19 — — US disclosed
EP-1692098-B1 ALPHA-KETOAMIDE DERIVATIVE, AND PRODUCTION METHOD AND USE THEREOF SENJU PHARMA CO (JP) 2009-10-28 — — EP disclosed
US-7491705-B2 Alpha-ketoamide derivative, and production method and use thereof SENJU PHARMACEUTICAL CO., LTD. (JP) 2009-02-17 — — US disclosed
US-20070004643-A1 Alpha-ketoamide derivative, and production method and use thereof SENJU PHARMACEUTICAL CO., LTD. (JP) 2007-01-04 — — 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 (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-20130244945-A1 LISSENCEPHALY THERAPEUTIC AGENT ASPH, DCX, ERH CAPN1 2767/4885TAS1R3 2530/4885TAS1R1 2102/4885
US-20070004643-A1 Alpha-ketoamide derivative, and production method and use thereof CAPN1, CAPN2, CAPNS1 CAPN1 1/4885TAS1R3 4142/4885TAS1R1 3946/4885
US-20160250276-A1 LISSENCEPHALY THERAPEUTIC AGENT ASPH, DCX, P4HA1 CAPN1 2695/4885TAS1R3 2511/4885TAS1R1 2185/4885

“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.

Send feedback