SCHEMBL727984

SCHEMBL727984

CCCC[Sn](CCCC)(CCCC)C(=O)O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKR1B1 P15121 1/20 0.42
GPR84 Q9NQS5 11/20 0.40
PPARG P37231 7/20 0.40
PPARD Q03181 7/20 0.40
PPARA Q07869 7/20 0.40
HDAC11 Q96DB2 5/20 0.40
TSHR P16473 4/20 0.40
PTPN1 P18031 3/20 0.40
ALDH1A1 P00352 2/20 0.40
TLR2 O60603 2/20 0.40
TDP1 Q9NUW8 2/20 0.40
FABP4 P15090 2/20 0.40
SLC22A6 Q4U2R8 1/20 0.40
SLC22A8 Q8TCC7 1/20 0.40
MEN1 O00255 1/20 0.40
ESR1 P03372 1/20 0.40
ALOX15 P16050 1/20 0.40
PDE4A P27815 1/20 0.40
KMT2A Q03164 1/20 0.40
PDE3A Q14432 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
SCHEMBL11856586 0.95 AKR1B1 (0.39) AKR1B1GPR84PPARGPPARDPPARA
SCHEMBL5132104 0.80 CES1 (0.41) AKR1B1GPR84PPARGPPARDPPARA
SCHEMBL8002430 0.79 AKR1B1 (0.39) AKR1B1GPR84PPARGPPARDPPARA
SCHEMBL1304592 0.78 AKR1B1 (0.42) AKR1B1GPR84PPARGPPARDPPARA
SCHEMBL18421166 0.78 CES1 (0.40) AKR1B1GPR84PPARGPPARDPPARA
SCHEMBL29229151 0.76 CES2 (0.38) AKR1B1GPR84PPARGPPARDPPARA
SCHEMBL7219686 0.76 CA1 (0.38) AKR1B1GPR84PPARGPPARDPPARA
SCHEMBL6012107 0.75 AKR1B1 (0.36) AKR1B1GPR84PPARGPPARDPPARA
SCHEMBL7894375 0.74 NAAA (0.37) AKR1B1GPR84PPARGPPARDPPARA
SCHEMBL28559823 0.74 CES1 (0.42) AKR1B1GPR84PPARGPPARDPPARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8137520-B1 Chloride ion-selective electrode CHUNG YUAN CHRISTIAN UNIVERSITY (TW) 2012-03-20 US claimed
US-8137520-B1 Chloride ion-selective electrode CHUNG YUAN CHRISTIAN UNIVERSITY (TW) 2012-03-20 US disclosed
US-4954472-A GLASS TRANSITION TEMPERATURE RAPRA TECHNOLOGY LIMITED (GB) 1990-09-04 US disclosed
EP-0321165-A2 Temperature activated catalysts for liquid polymer cures RAPRA TECHNOLOGY LIMITED (GB) 1989-06-21 EP disclosed
US-4082709-A ALKYD RESINS CROSSLINKED BY UNSATURATED ORGANOTIN ESTERS, MARINE THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) 1978-04-04 US disclosed
US-4075319-A Low leaching antifouling organometallic polyvinyls THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) 1978-02-21 US disclosed
US-3979354-A EPOXY RESINS, ORGANOTIN CROSSLINKING AGENT THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) 1976-09-07 US disclosed
US-3933877-A Hydrophilic and difficultly volatile biocidal triorganometallic compounds CIBA-GEIGY CORPORATION (US) 1976-01-20 US disclosed
US-3931262-A Hydrophilic and difficultly volatile biocidal triorganotin compounds CIBA-GEIGY CORPORATION (US) 1976-01-06 US disclosed