SCHEMBL5120004

SCHEMBL5120004

CCOC(=O)CCc1cc(O)nn1CC

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 2/20 0.42
CYP4A11 Q02928 2/20 0.42
LMNA P02545 2/20 0.41
ALDH1A1 P00352 4/20 0.40
RECQL P46063 1/20 0.39
TSHR P16473 2/20 0.38
NPC1 O15118 1/20 0.38
POLB P06746 1/20 0.38
RAB9A P51151 1/20 0.38
KDM4E B2RXH2 2/20 0.38
HPGD P15428 2/20 0.38
HSD17B10 Q99714 2/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
MAPT P10636 1/20 0.37
GLA P06280 1/20 0.36
GAA P10253 1/20 0.36
CASP1 P29466 1/20 0.36
CASP7 P55210 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36

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
SCHEMBL5120409 0.86 CYP4F2 (0.38) CYP4F2CYP4A11LMNAALDH1A1TSHR
SCHEMBL5108956 0.84 LMNA (0.48) CYP4F2CYP4A11LMNAALDH1A1TSHR
SCHEMBL5119177 0.83 ALDH1A1 (0.49) CYP4F2CYP4A11LMNAALDH1A1POLB
SCHEMBL5106638 0.80 CYP4F2 (0.40) CYP4F2CYP4A11LMNAALDH1A1TSHR
SCHEMBL3217811 0.78 PPARG (0.55) LMNAALDH1A1RAB9A
SCHEMBL5111929 0.78 KMT2A (0.54) CYP4F2CYP4A11LMNAALDH1A1TSHR
SCHEMBL23398397 0.76 ADORA2A (0.33) LMNA
SCHEMBL5113795 0.75 HRH3 (0.40) CYP4F2CYP4A11LMNAALDH1A1TSHR
SCHEMBL21570111 0.73 LMNA (0.49) CYP4F2CYP4A11LMNAALDH1A1TSHR
SCHEMBL23399833 0.73 NPC1 (0.36) LMNANPC1POLBRAB9AKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080051418-A1 Arylalkanoic Acid Derivative TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-02-28 US disclosed
EP-1829863-A1 ARYLALKANOIC ACID DERIVATIVE Takeda Pharmaceutical Company Limited (JP) 2007-09-05 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-20080051418-A1 Arylalkanoic Acid Derivative INSR, NPY1R, GPR119 CYP4F2 1398/4885CYP4A11 520/4885LMNA 3761/4885

“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.