SCHEMBL5737702

SCHEMBL5737702

CCOC(=Cc1ccc(OCc2ccccc2)nc1)C(=O)O

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NR1H4 Q96RI1 1/20 0.51
FFAR1 O14842 3/20 0.50
LMNA P02545 2/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
CHRNB2 P17787 1/20 0.43
CHRNA7 P36544 1/20 0.43
CHRNA4 P43681 1/20 0.43
KDM4E B2RXH2 1/20 0.41
CXCR2 P25025 1/20 0.41
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
MRGPRX4 Q96LA9 1/20 0.40
GRM5 P41594 1/20 0.40
ALDH1A1 P00352 1/20 0.40
ACACB O00763 1/20 0.40
ACACA Q13085 1/20 0.40
PABPC1 P11940 1/20 0.40
MAPT P10636 1/20 0.40

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
SCHEMBL5737694 1.00 NR1H4 (0.51) NR1H4FFAR1LMNAL3MBTL1CHRNB2
SCHEMBL3978522 0.83 NR1H4 (0.72) NR1H4LMNAL3MBTL1KDM4EALDH1A1
SCHEMBL3978531 0.83 NR1H4 (0.72) NR1H4LMNAL3MBTL1KDM4EALDH1A1
SCHEMBL5737698 0.82 TBXAS1 (0.52) NR1H4FFAR1LMNACHRNB2CHRNA7
SCHEMBL3688515 0.80 CA12 (0.55) NR1H4FFAR1LMNAKDM4E
SCHEMBL3688513 0.80 CA12 (0.55) NR1H4FFAR1LMNAKDM4E
SCHEMBL6816300 0.79 FFAR4 (0.52) NR1H4LMNAL3MBTL1KDM4EMRGPRX4
SCHEMBL6816289 0.79 FFAR4 (0.52) NR1H4LMNAL3MBTL1KDM4EMRGPRX4
SCHEMBL4342685 0.78 MEN1 (0.58) NR1H4LMNAL3MBTL1KDM4EMEN1
SCHEMBL4342680 0.78 MEN1 (0.58) NR1H4LMNAL3MBTL1KDM4EMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1615899-A1 ALPHA-SUBSTITUTED CARBOXYLIC ACIDS AS PPAR MODULATORS PFIZER INC. (US) 2006-01-18 EP disclosed
US-20050234066-A1 Alpha substituted carboxylic acids AGOURON PHARMACEUTICALS, INC. 2005-10-20 US disclosed
US-20050187266-A1 Alpha substituted carboxylic acids PFIZER INC 2005-08-25 US disclosed
WO-2004092145-A1 ALPHA SUBSTITUTED CARBOXYLIC ACID AS PPAR MODULATORS PFIZER INC. (US) 2004-10-28 WO 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 (2 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-20050234066-A1 Alpha substituted carboxylic acids PPARG, PPARA, PPARD NR1H4 70/4885FFAR1 5/4885LMNA 2903/4885
US-20050187266-A1 Alpha substituted carboxylic acids PPARG, PPARA, PPARD NR1H4 70/4885FFAR1 5/4885LMNA 2903/4885

“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.