SCHEMBL10299221

SCHEMBL10299221

O=COC1CCCC(C(=O)O)C1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BTK Q06187 1/20 0.39
ANPEP P15144 1/20 0.36
ACE P12821 1/20 0.35
TSHR P16473 3/20 0.34
SLC6A1 P30531 2/20 0.34
SLC6A11 P48066 1/20 0.34
LMNA P02545 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
SLC6A13 Q9NSD5 1/20 0.34
EPHX2 P34913 1/20 0.34
GABRR1 P24046 1/20 0.32
PDE4A P27815 1/20 0.31
PDE4B Q07343 1/20 0.31
PDE4C Q08493 1/20 0.31
PDE4D Q08499 1/20 0.31
AKR1C3 P42330 1/20 0.31
AKR1C1 Q04828 1/20 0.31
GABRP O00591 1/20 0.30
GABRD O14764 1/20 0.30
GABRA1 P14867 1/20 0.30

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
SCHEMBL15725229 1.00 BTK (0.39) BTKANPEPACETSHRSLC6A1
SCHEMBL5353331 0.88 ACE (0.41) BTKACETSHRLMNAGABRR1
SCHEMBL24687706 0.83 BTK (0.38) BTKANPEPACETSHRSLC6A1
SCHEMBL24687493 0.83 BTK (0.38) BTKANPEPACETSHRSLC6A1
SCHEMBL22613896 0.81 CYP2C19 (0.33) ACETSHRSLC6A11SLC6A13GABRR1
SCHEMBL14944735 0.79 ACE (0.35) ACETSHRGABRR1GABRPGABRD
SCHEMBL10073556 0.79 ACE (0.35) ACETSHRGABRR1GABRPGABRD
SCHEMBL14425477 0.76 BTK (0.45) BTKANPEPACETSHRSLC6A1
SCHEMBL14042369 0.76 BTK (0.45) BTKANPEPACETSHRSLC6A1
SCHEMBL504043 0.76 BTK (0.45) BTKANPEPACETSHRSLC6A1

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
US-11780961-B2 Organic metal-free catalysts with electrophilic and nucleophilic dual-functions, preparation methods of making the same, and uses thereof ZHEJIANG UNIVERSITY (CN) 2023-10-10 US disclosed
US-20150291576-A1 COMPOUNDS AND THEIR METHODS OF USE SERVIER PHARMACEUTICALS LLC 2015-10-15 US disclosed
US-9051452-B2 Polymer compositions for temporary bonding PROMERUS, LLC (US) 2015-06-09 US disclosed
US-9029531-B2 Compounds and their methods of use AGIOS PHARMACEUTICALS, INC. (US) 2015-05-12 US disclosed
US-20140142081-A1 COMPOUNDS AND THEIR METHODS OF USE AGIOS PHARMACEUTICALS, INC (US) 2014-05-22 US disclosed
US-8633259-B2 Polymer compositions for temporary bonding PROMERUS, LLC (US) 2014-01-21 US disclosed
US-20120172479-A1 POLYMER COMPOSITIONS FOR TEMPORARY BONDING PROMERUS LLC (US) 2012-07-05 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-20150291576-A1 COMPOUNDS AND THEIR METHODS OF USE GLS, GLS2, GLUL BTK 2545/4885ANPEP 386/4885ACE 158/4885
US-11780961-B2 Organic metal-free catalysts with electrophilic and nucleophilic dual-functions, preparation methods of making the same, and uses thereof DUOX1, SOD1, DUOX2 BTK 987/4885ANPEP 1179/4885ACE 1277/4885
US-20140142081-A1 COMPOUNDS AND THEIR METHODS OF USE GLS, GLS2, GLUL BTK 2857/4885ANPEP 328/4885ACE 481/4885

“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.