SCHEMBL4100780

SCHEMBL4100780

CCOC(=O)C(C)(C)CCCC(=O)O

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 2/20 0.62
CYP4A11 Q02928 2/20 0.62
THRB P10828 1/20 0.41
PKM P14618 1/20 0.41
AKR1B1 P15121 1/20 0.40
HTT P42858 1/20 0.40
GPR84 Q9NQS5 7/20 0.39
PPARG P37231 7/20 0.39
PPARD Q03181 7/20 0.39
PPARA Q07869 7/20 0.39
HDAC11 Q96DB2 5/20 0.39
TSHR P16473 4/20 0.39
PTPN1 P18031 3/20 0.39
ALDH1A1 P00352 2/20 0.39
TLR2 O60603 2/20 0.39
TDP1 Q9NUW8 2/20 0.39
FABP4 P15090 2/20 0.39
SLC22A6 Q4U2R8 1/20 0.39
SLC22A8 Q8TCC7 1/20 0.39
MEN1 O00255 1/20 0.39

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
SCHEMBL22190459 0.93 CYP4F2 (0.69) CYP4F2CYP4A11THRBPKMAKR1B1
SCHEMBL759138 0.88 CYP4F2 (0.56) CYP4F2CYP4A11THRBPKMHTT
SCHEMBL2116494 0.85 CYP4F2 (0.62) CYP4F2CYP4A11THRBPKMHTT
SCHEMBL6254544 0.84 CYP4F2 (0.85) CYP4F2CYP4A11THRBPKMHTT
SCHEMBL6257314 0.84 CYP4F2 (0.85) CYP4F2CYP4A11THRBPKMHTT
SCHEMBL3280400 0.82 CYP4F2 (0.56) CYP4F2CYP4A11THRBPKMHTT
SCHEMBL7941258 0.82 CYP4F2 (0.69) CYP4F2CYP4A11THRBPKMHTT
SCHEMBL16280582 0.81 CYP4F2 (0.50) CYP4F2CYP4A11AKR1B1GPR84PPARG
SCHEMBL186836 0.81 CYP4F2 (0.58) CYP4F2CYP4A11THRBPKMHTT
SCHEMBL28100915 0.81 CYP4F2 (0.58) CYP4F2CYP4A11THRBPKMHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1882684-B1 PYRROLIDINE DERIVATIVE OR SALT THEREOF ASTELLAS PHARMA INC (JP) 2014-12-10 EP disclosed
US-7585886-B2 Pyrrolidine derivative or salt thereof ASTELLAS PHARMA INC. (JP) 2009-09-08 US disclosed
US-20090062366-A1 Pyrrolidine derivative or salt thereof ASTELLAS PHARAMA INC. (JP) 2009-03-05 US disclosed
EP-1882684-A1 PYRROLIDINE DERIVATIVE OR SALT THEREOF Astellas Pharma Inc. (JP) 2008-01-30 EP disclosed
EP-0765857-B1 PROCESS FOR PRODUCING OPTICALLY ACTIVE ALPHA-SUBSTITUTED CARBOXYLIC ACID DERIVATIVES MITSUBISHI RAYON CO (JP) 1999-12-08 EP disclosed
US-5773240-A Optically active α-substituted carboxylic acid derivatives and method for producing the same MITSUBISHI RAYON CO., LTD. (JP) 1998-06-30 US disclosed
EP-0765857-A1 OPTICALLY ACTIVE ALPHA-SUBSTITUTED CARBOXYLIC ACID DERIVATIVE AND PROCESS FOR PRODUCING THE SAME MITSUBISHI RAYON CO., LTD. (JP) 1997-04-02 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-20090062366-A1 Pyrrolidine derivative or salt thereof CASR, CYP2R1, PTH1R CYP4F2 473/4885CYP4A11 154/4885THRB 343/4885

“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.