SCHEMBL2234149

SCHEMBL2234149

CC(CC(C(N)=O)c1ccc(-c2ccccc2)c(F)c1)c1ccccc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKR1C3 P42330 6/20 0.59
AKR1C2 P52895 6/20 0.59
LMNA P02545 5/20 0.59
PTGS1 P23219 4/20 0.59
MEN1 O00255 3/20 0.59
KMT2A Q03164 3/20 0.59
MAPT P10636 3/20 0.59
PTGS2 P35354 2/20 0.59
FABP2 P12104 1/20 0.59
TSHR P16473 1/20 0.59
AKR1C4 P17516 1/20 0.59
ADRA2B P18089 1/20 0.59
CHRM3 P20309 1/20 0.59
HTR2C P28335 1/20 0.59
DRD3 P35462 1/20 0.59
AKR1C1 Q04828 1/20 0.59
SLC22A6 Q4U2R8 1/20 0.59
CYP1A2 P05177 1/20 0.59
CYP2C9 P11712 1/20 0.59
HPGD P15428 1/20 0.59

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
SCHEMBL2357848 0.81 LMNA (0.78) AKR1C3AKR1C2LMNAPTGS1MEN1
SCHEMBL5319051 0.81 LMNA (0.78) AKR1C3AKR1C2LMNAPTGS1MEN1
SCHEMBL986661 0.80 LMNA (0.63) AKR1C3AKR1C2LMNAPTGS1MEN1
SCHEMBL1543801 0.78 AKR1C3 (0.50) AKR1C3AKR1C2LMNAPTGS1MEN1
SCHEMBL12327040 0.77 LMNA (0.59) AKR1C3AKR1C2LMNAPTGS1MEN1
SCHEMBL12327023 0.77 LMNA (0.59) AKR1C3AKR1C2LMNAPTGS1MEN1
SCHEMBL11861696 0.77 LMNA (0.67) AKR1C3AKR1C2LMNAPTGS1MEN1
SCHEMBL4201800 0.77 AKR1C3 (0.76) AKR1C3AKR1C2LMNAPTGS1MEN1
SCHEMBL11804390 0.76 AKR1C3 (0.61) AKR1C3AKR1C2LMNAPTGS1MEN1
SCHEMBL988019 0.76 LMNA (0.65) AKR1C3AKR1C2LMNAPTGS1MEN1

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-20110172460-A1 PROCESS FOR THE MANUFACTURE OF RACEMIC 2-ARYL-PROPIONIC ACID AESICA PHARMACEUTICALS LIMITED (GB) 2011-07-14 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-20110172460-A1 PROCESS FOR THE MANUFACTURE OF RACEMIC 2-ARYL-PROPIONIC ACID SRR, GABBR2, GRHPR AKR1C3 92/4885AKR1C2 199/4885LMNA 4065/4885

“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.