SCHEMBL6677041

SCHEMBL6677041

C=CCC1C(=O)CCCN1C(=O)O

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.35
ALDH1A1 P00352 1/20 0.35
KMT2A Q03164 1/20 0.35
OPRK1 P41145 1/20 0.34
FAAH O00519 1/20 0.33
ELANE P08246 2/20 0.31
CTSG P08311 1/20 0.31
DPP4 P27487 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
SCHEMBL8132766 0.82 ELANE (0.36) MEN1ALDH1A1KMT2AOPRK1FAAH
SCHEMBL30911200 0.80 FAAH (0.36) FAAHELANECTSG
SCHEMBL25765744 0.79 ATM (0.38) MEN1ALDH1A1KMT2A
SCHEMBL25759340 0.77 ELANE (0.55) ELANECTSG
SCHEMBL25764940 0.75 MEN1 (0.34) MEN1ALDH1A1KMT2A
SCHEMBL8404674 0.73 MEN1 (0.33) MEN1ALDH1A1KMT2A
SCHEMBL12924902 0.73 MEN1 (0.33) MEN1ALDH1A1KMT2A
SCHEMBL5747840 0.72 PSEN1 (0.44) ALDH1A1KMT2AOPRK1
Hydrochloric Acid SCHEMBL6998893 0.71 PSEN1 (0.43) ALDH1A1KMT2AOPRK1
SCHEMBL3420510 0.70 LMNA (0.31) ALDH1A1KMT2AOPRK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1136475-B1 Piperidine and piperazine compounds for use in the treatment of Alzheimer HOFFMANN LA ROCHE (CH) 2004-08-18 EP claimed
US-6605723-B2 Reacting a protected amino acid ester with a 4-substituted butyric acid derivative, cyclizing the protected intermediate, benzylating and decarboxylating the intermediate, asymmetric hydrogenation using a catalyst HOFFMAN-LA ROCHE INC. 2003-08-12 US claimed
US-20010037026-A1 Process for the preparation of ethanesul fonyl-piperidine derivatives EVOTEC INTERNATIONAL GMBH (DE) 2001-11-01 US claimed
US-6605723-B2 Reacting a protected amino acid ester with a 4-substituted butyric acid derivative, cyclizing the protected intermediate, benzylating and decarboxylating the intermediate, asymmetric hydrogenation using a catalyst HOFFMAN-LA ROCHE INC. 2003-08-12 US disclosed
US-20010037026-A1 Process for the preparation of ethanesul fonyl-piperidine derivatives EVOTEC INTERNATIONAL GMBH (DE) 2001-11-01 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-20010037026-A1 Process for the preparation of ethanesul fonyl-piperidine derivatives GRIN1, GRIN3A, GRIN2B MEN1 852/4885ALDH1A1 1434/4885KMT2A 2102/4885

“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.