SCHEMBL4921807

SCHEMBL4921807

CCOc1ccc(CCN(CCC(=O)O)C(=O)c2ccccc2-c2ccccc2C(=O)NCc2ccc(OC)cc2)cc1OC

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.46
HPGD P15428 2/20 0.46
POLB P06746 2/20 0.46
TP53 P04637 2/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
APP P05067 1/20 0.45
RAB9A P51151 1/20 0.44
PPARA Q07869 3/20 0.44
PPARG P37231 1/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
PPARD Q03181 1/20 0.43
TAS1R3 Q7RTX0 1/20 0.43
TAS1R1 Q7RTX1 1/20 0.43
MAPT P10636 1/20 0.42
APEX1 P27695 1/20 0.42

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
SCHEMBL5392437 0.97 LMNA (0.46) LMNAHPGDPOLBTP53SMN1; SMN2
SCHEMBL5403428 0.96 APP (0.49) LMNAHPGDTP53SMN1; SMN2APP
SCHEMBL5398699 0.94 RAB9A (0.48) HPGDTP53SMN1; SMN2RAB9APPARA
SCHEMBL4931284 0.93 PPARA (0.46) LMNAHPGDTP53APPRAB9A
SCHEMBL5392202 0.93 RAB9A (0.55) LMNAHPGDPOLBAPPRAB9A
SCHEMBL4931927 0.93 LMNA (0.45) LMNAHPGDSMN1; SMN2APPPPARA
SCHEMBL4928591 0.93 LMNA (0.47) LMNAHPGDTP53SMN1; SMN2APP
SCHEMBL5403132 0.93 LMNA (0.48) LMNAHPGDTP53SMN1; SMN2APP
SCHEMBL5406126 0.91 PPARA (0.48) LMNAHPGDSMN1; SMN2APPRAB9A
SCHEMBL5405907 0.90 LMNA (0.45) LMNAHPGDTP53SMN1; SMN2APP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080064731-A1 REMEDY FOR CHRONIC DISEASE ONO PHARMACEUTICAL CO.,LTD. 2008-03-13 US disclosed
US-7300917-B2 Remedy for chronic disease ONO PHARMACEUTICALS CO., LTD. (JP) 2007-11-27 US disclosed
US-7285680-B2 β-alanine derivatives and the use thereof ONO PHARMACEUTICAL CO., LTD. (JP) 2007-10-23 US disclosed
US-20060135577-A1 Remedy for chronic disease ONO PHARMACEUTICAL CO., LTD. (JP) 2006-06-22 US disclosed
US-20050256160-A1 Beta-alanine derivatives and the use thereof ONO PHARMACEUTICAL CO., LTD. (JP) 2005-11-17 US disclosed
EP-1550461-A1 REMEDY FOR CHRONIC DISEASE ONO PHARMACEUTICAL CO., LTD. (JP) 2005-07-06 EP disclosed
EP-1533294-A1 BETA-ALANINE DERIVATIVE AND USE THEREOF ONO PHARMACEUTICAL CO., LTD. (JP) 2005-05-25 EP 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-20050256160-A1 Beta-alanine derivatives and the use thereof TGFB1, PML, APOB LMNA 308/4885HPGD 1078/4885POLB 527/4885
US-20080064731-A1 REMEDY FOR CHRONIC DISEASE EDNRA, EDNRB, LPAR2 LMNA 2447/4885HPGD 993/4885POLB 3551/4885
US-20060135577-A1 Remedy for chronic disease EDNRA, EDNRB, LPAR2 LMNA 2447/4885HPGD 993/4885POLB 3551/4885

“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.