SCHEMBL14969336

SCHEMBL14969336

CCCCCOc1ccc(C(=O)NC)cc1

nearest known ligand 0.93

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PLK1 P53350 2/20 0.81
TP53 P04637 1/20 0.66
TSHR P16473 1/20 0.66
PLA2G4B P0C869 1/20 0.64
RARB P10826 3/20 0.60
PPARG P37231 2/20 0.60
PPARA Q07869 1/20 0.60
MMP1 P03956 1/20 0.60
NR1H4 Q96RI1 1/20 0.59
LMNA P02545 1/20 0.58
STAT3 P40763 1/20 0.58
SMN1; SMN2 Q16637 1/20 0.58
GAA P10253 1/20 0.58

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
SCHEMBL14969349 0.98 PLK1 (0.79) PLK1TP53TSHRPLA2G4BRARB
SCHEMBL12113898 0.98 PLK1 (0.79) PLK1TP53TSHRPLA2G4BRARB
SCHEMBL12112441 0.98 PLK1 (0.79) PLK1TP53TSHRPLA2G4BRARB
SCHEMBL12839873 0.97 PLK1 (0.87) PLK1TP53TSHRPLA2G4BMMP1
SCHEMBL23484979 0.95 PLK1 (0.74) PLK1TP53TSHRPLA2G4BRARB
SCHEMBL11962158 0.90 PLK1 (1.00) PLK1TSHRLMNASMN1; SMN2
SCHEMBL28597433 0.87 PLK1 (0.62) PLK1TP53TSHRPLA2G4BRARB
SCHEMBL14880202 0.87 MMP1 (0.68) PLK1TP53TSHRPLA2G4BPPARG
SCHEMBL6189807 0.87 PLK1 (0.71) PLK1TP53TSHRMMP1SMN1; SMN2
SCHEMBL7330555 0.87 TP53 (0.66) PLK1TP53TSHRPLA2G4BRARB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130131134-A1 PHENYLPROPIONIC ACID DERIVATIVE AND USE THEREOF MORITA KOHEI (JP) 2013-05-23 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-20130131134-A1 PHENYLPROPIONIC ACID DERIVATIVE AND USE THEREOF PLA2G12A, PLA2G4A, PLA2G4B PLK1 1861/4885TP53 4654/4885TSHR 4126/4885

“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.