SCHEMBL5843161

SCHEMBL5843161

CCCC(=O)OC(C)N1CCOCC1

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.46
ALDH1A1 P00352 4/20 0.46
RAB9A P51151 2/20 0.46
MAPT P10636 1/20 0.46
HPGD P15428 1/20 0.46
KMT2A Q03164 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
TSHR P16473 3/20 0.42
POLB P06746 3/20 0.42
CYP3A4 P08684 1/20 0.40
CYP2C19 P33261 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
GLA P06280 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
GAA P10253 1/20 0.39
RECQL P46063 1/20 0.38
HTT P42858 1/20 0.37

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
Hydrochloric Acid SCHEMBL5843120 0.98 ALDH1A1 (0.45) LMNAALDH1A1RAB9AMAPTHPGD
SCHEMBL15844822 0.87 LMNA (0.57) LMNAALDH1A1RAB9AMAPTKMT2A
SCHEMBL12246311 0.79 ALDH1A1 (0.42) LMNAALDH1A1RAB9AMAPTHPGD
SCHEMBL6836087 0.78 L3MBTL1 (0.56) ALDH1A1RAB9AKMT2ANPSR1TSHR
SCHEMBL21026773 0.76 ALDH1A1 (0.40) LMNAALDH1A1RAB9AMAPTHPGD
SCHEMBL15174342 0.76 KMT2A (0.41) LMNAALDH1A1RAB9AMAPTHPGD
SCHEMBL15174290 0.76 HCAR2 (0.45) LMNAALDH1A1RAB9AMAPTHPGD
SCHEMBL15174291 0.76 HCAR2 (0.45) LMNAALDH1A1RAB9AMAPTHPGD
SCHEMBL7382077 0.75 ALDH1A1 (0.37) LMNAALDH1A1RAB9AMAPTHPGD
SCHEMBL465226 0.74 LMNA (0.45) LMNAALDH1A1RAB9AMAPTHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7034020-B2 Derivatives of butyric acid and uses thereof THE UNIVERSITY OF ARKANSAS FOR MEDICAL SCIENCE (US) 2006-04-25 US disclosed
US-20040127564-A1 Derivatives of butyric acid and uses thereof THE UNIVERSITY OF ARKANSAS FOR MEDICAL SCIENCES 2004-07-01 US disclosed
US-6664394-B2 As inactivator of antigen- specific T cells is useful in the prophylaxis or therapy of autoimmune diseases, disorders involving an autoimmune component or neoplastic diseases THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ARKANSAS 2003-12-16 US disclosed
US-20020143056-A1 Derivatives of butyric acid and uses thereof THE UNIVERSITY OF ARKANSAS FOR MEDICAL SCIENCES 2002-10-03 US disclosed
US-6407107-B1 4-(MORPHOLINO)ALKYL BUTANAMIDE DERIVATIVES; AUTOIMMUNE DISEASES; ANTICARCINOGENIC AGENTS THE BOARD OF TRUSTEES OF THE UNVERSITY OF ARKANSAS 2002-06-18 US disclosed
WO-2000073257-A1 DERIVATIVES OF BUTYRIC ACID AND USES THEREOF THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ARKANSAS (US) 2000-12-07 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 (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-20020143056-A1 Derivatives of butyric acid and uses thereof CD4, NFATC1, GABRA4 LMNA 2350/4885ALDH1A1 858/4885RAB9A 4163/4885
US-20040127564-A1 Derivatives of butyric acid and uses thereof CD4, NFATC1, GABRA4 LMNA 2318/4885ALDH1A1 849/4885RAB9A 4109/4885

“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.