SCHEMBL2482032

SCHEMBL2482032

CC(=O)OC(CC(C)C)C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 6/20 0.49
LAP3 P28838 2/20 0.46
TSHR P16473 2/20 0.44
RNPEP Q9H4A4 1/20 0.43
SLC7A5 Q01650 1/20 0.43
ALDH1A1 P00352 1/20 0.42
CHRM2 P08172 1/20 0.39
CHRM4 P08173 1/20 0.39
CHRM1 P11229 1/20 0.39
TBXA2R P21731 1/20 0.39
CACNA2D1 P54289 2/20 0.38
CACNB3 P54284 1/20 0.38
CACNA1C Q13936 1/20 0.38
PGR P06401 1/20 0.38
ADRA1A P35348 1/20 0.38
HTR2B P41595 1/20 0.38
CACNA2D2 Q9NY47 1/20 0.38
SLC1A3 P43003 1/20 0.38
SLC1A2 P43004 1/20 0.38
GALR3 O60755 1/20 0.38

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
SCHEMBL16286566 1.00 FOLH1 (0.49) FOLH1LAP3TSHRRNPEPSLC7A5
SCHEMBL19301334 0.84 FOLH1 (0.50) FOLH1LAP3RNPEPSLC7A5ALDH1A1
SCHEMBL6904512 0.84 TSHR (0.46) FOLH1LAP3TSHRRNPEPSLC7A5
SCHEMBL9421350 0.81 TSHR (0.39) FOLH1LAP3TSHRCHRM2CHRM4
SCHEMBL5349776 0.80 TSHR (0.42) FOLH1LAP3TSHRRNPEPSLC7A5
SCHEMBL5349785 0.80 TSHR (0.42) FOLH1LAP3TSHRRNPEPSLC7A5
SCHEMBL8613929 0.80 FOLH1 (0.47) FOLH1LAP3RNPEPSLC7A5ALDH1A1
SCHEMBL28022777 0.80 TSHR (0.42) FOLH1LAP3TSHRCHRM2CHRM4
SCHEMBL15945449 0.78 TSHR (0.41) FOLH1TSHRALDH1A1CHRM2CHRM4
SCHEMBL28022769 0.78 FOLH1 (0.46) FOLH1LAP3RNPEPSLC7A5ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104755510-A Ziegler-Natta catalyst systems comprising a 1,2-phenylenedioate as internal donor and process for preparing the same INDIAN OIL CORP LTD 2015-07-01 CN claimed
CN-104755510-B Ziegler natta catalyst system of internal donor and preparation method thereof is used as comprising 1,2 phenylene diester 印度石油有限公司 2017-11-07 CN disclosed
EP-3116031-A1 ORGANIC THIN FILM TRANSISTOR AND METHOD FOR MANUFACTURING SAME Fujifilm Corporation (JP) 2017-01-11 EP disclosed
CN-104755510-A Ziegler-Natta catalyst systems comprising a 1,2-phenylenedioate as internal donor and process for preparing the same INDIAN OIL CORP LTD 2015-07-01 CN disclosed
EP-1735332-B1 AZACYCLOSTEROID HISTAMINE-3 RECEPTOR LIGANDS ABBOTT LAB (US) 2011-10-19 EP disclosed
US-20080113982-A1 AZACYCLOSTEROID HISTAMINE-3 RECEPTOR LIGANDS ZHAO CHEN 2008-05-15 US disclosed
US-7345034-B2 Azacyclosteroid histamine-3 receptor ligands ABBOTT LABORATORIES (US) 2008-03-18 US disclosed
EP-1735332-A1 AZACYCLOSTEROID HISTAMINE-3 RECEPTOR LIGANDS ABBOTT LABORATORIES (US) 2006-12-27 EP disclosed
US-20050245495-A1 Azacyclosteroid histamine-3 receptor ligands ABBOTT LABORATORIES 2005-11-03 US disclosed
WO-2005100377-A1 AZACYCLOSTEROID HISTAMINE-3 RECEPTOR LIGANDS ABBOTT LABORATORIES (US) 2005-10-27 WO disclosed
US-20050227953-A1 Azacyclosteroid histamine-3 receptor ligands ABBVIE INC. 2005-10-13 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 (3 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-20050227953-A1 Azacyclosteroid histamine-3 receptor ligands HRH4, HRH3, HRH2 FOLH1 1509/4885LAP3 1582/4885TSHR 304/4885
US-20050245495-A1 Azacyclosteroid histamine-3 receptor ligands HRH4, HRH3, HRH2 FOLH1 1509/4885LAP3 1582/4885TSHR 304/4885
US-20080113982-A1 AZACYCLOSTEROID HISTAMINE-3 RECEPTOR LIGANDS HRH4, HRH3, HRH2 FOLH1 1509/4885LAP3 1582/4885TSHR 304/4885

“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.