SCHEMBL5392437

SCHEMBL5392437

CCOc1cc(CCN(CCC(=O)O)C(=O)c2ccccc2-c2ccccc2C(=O)NCc2ccc(OC)cc2)ccc1OC

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.46
TP53 P04637 3/20 0.46
HPGD P15428 2/20 0.46
POLB P06746 2/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
RAB9A P51151 1/20 0.44
PPARA Q07869 3/20 0.44
PPARG P37231 1/20 0.44
MAPT P10636 2/20 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

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
SCHEMBL4921807 0.97 LMNA (0.46) LMNATP53HPGDPOLBSMN1; SMN2
SCHEMBL5403132 0.96 LMNA (0.48) LMNATP53HPGDSMN1; SMN2RAB9A
SCHEMBL5398699 0.94 RAB9A (0.48) TP53HPGDSMN1; SMN2RAB9APPARA
SCHEMBL5397415 0.93 PPARA (0.46) LMNATP53HPGDSMN1; SMN2RAB9A
SCHEMBL5408530 0.93 RAB9A (0.55) LMNATP53HPGDPOLBRAB9A
SCHEMBL5401067 0.93 LMNA (0.47) LMNATP53HPGDSMN1; SMN2RAB9A
SCHEMBL5436037 0.93 PTGDR2 (0.46) LMNATP53HPGDRAB9APPARA
SCHEMBL5403428 0.93 APP (0.49) LMNATP53HPGDSMN1; SMN2RAB9A
SCHEMBL5401045 0.91 PPARA (0.48) LMNATP53HPGDSMN1; SMN2RAB9A
SCHEMBL5409385 0.90 MEN1 (0.46) LMNATP53HPGDSMN1; SMN2RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7285680-B2 β-alanine derivatives and the use thereof ONO PHARMACEUTICAL CO., LTD. (JP) 2007-10-23 US disclosed
US-20050256160-A1 Beta-alanine derivatives and the use thereof ONO PHARMACEUTICAL CO., LTD. (JP) 2005-11-17 US 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 (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-20050256160-A1 Beta-alanine derivatives and the use thereof TGFB1, PML, APOB LMNA 308/4885TP53 32/4885HPGD 1078/4885

“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.