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Sugi Predict / Compounds / SCHEMBL11041995

SCHEMBL11041995

SCHEMBL11041995

O=C(OC(=O)c1cc(Cl)cc(Cl)c1)c1cc(Cl)cc(Cl)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TPMT P51580 1/20 0.56
▸ TSHR P16473 2/20 0.43
▸ HTR3E A5X5Y0 1/20 0.43
▸ GMNN O75496 1/20 0.43
▸ HTR3B O95264 1/20 0.43
▸ CYP1A2 P05177 1/20 0.43
▸ CYP2D6 P10635 1/20 0.43
▸ ALOX15 P16050 1/20 0.43
▸ MTOR P42345 1/20 0.43
▸ HTR3A P46098 1/20 0.43
▸ PMP22 Q01453 1/20 0.43
▸ HTR3D Q70Z44 1/20 0.43
▸ HTR3C Q8WXA8 1/20 0.43
▸ HSD17B10 Q99714 1/20 0.43
▸ HCAR1 Q9BXC0 1/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ ALDH1A1 P00352 1/20 0.43
▸ MAPT P10636 1/20 0.43
▸ HPGD P15428 1/20 0.43
▸ XBP1 P17861 1/20 0.43

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
SCHEMBL11041998 0.87 TPMT (0.50) TPMTTSHRMEN1ALDH1A1MAPT
SCHEMBL6672858 0.84 TPMT (0.56) TPMTTSHRHTR3EGMNNHTR3B
SCHEMBL3595404 0.82 TPMT (0.54) TPMTTSHRHTR3EGMNNHTR3B
SCHEMBL6965570 0.82 TPMT (0.54) TPMTTSHRHTR3EGMNNHTR3B
SCHEMBL588343 0.80 ALDH1A1 (0.62) TPMTTSHRHTR3EGMNNHTR3B
SCHEMBL29236450 0.80 TPMT (0.52) TPMTTSHRHTR3EGMNNHTR3B
SCHEMBL14889131 0.80 TPMT (0.42) TPMTTSHRHTR3EGMNNHTR3B
SCHEMBL27891764 0.80 TPMT (0.42) TPMTTSHRHTR3EGMNNHTR3B
SCHEMBL11766580 0.78 RXRA (0.54) TPMTRXRARXRB
SCHEMBL11557831 0.77 HPGD (0.42) TPMTTSHRHTR3EHTR3BHTR3A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113372290-A Synthetic method of drug Tafamidis 遵义医科大学 2021-09-10 — — CN claimed
US-20180273819-A1 THERMAL ENERGY STORAGE PHASE AND TEMPERATURE STABILIZATION CHANGE MATERIALS COMPRISING TRIAMINES AND METHODS FOR MAKING AND USING THEM ENTROPY SOLUTIONS LLC (US) 2018-09-27 — — US claimed
WO-2016179028-A1 THERMAL ENERGY STORAGE PHASE AND TEMPERATURE STABILIZATION CHANGE MATERIALS AND METHODS FOR MAKING AND USING THEM ENTROPY SOLUTIONS, LLC. (US) 2016-11-10 — — WO claimed
WO-2025015175-A2 HEATING, VENTILATION, AND AIR CONDITIONING (HVAC) SYSTEMS AND METHODS FOR USING SAME STASIS ENERGY GROUP, LLC (US) 2025-01-16 — — WO disclosed
CN-113372290-A Synthetic method of drug Tafamidis 遵义医科大学 2021-09-10 — — CN disclosed
US-20180273819-A1 THERMAL ENERGY STORAGE PHASE AND TEMPERATURE STABILIZATION CHANGE MATERIALS COMPRISING TRIAMINES AND METHODS FOR MAKING AND USING THEM ENTROPY SOLUTIONS LLC (US) 2018-09-27 — — US disclosed
WO-2016179028-A1 THERMAL ENERGY STORAGE PHASE AND TEMPERATURE STABILIZATION CHANGE MATERIALS AND METHODS FOR MAKING AND USING THEM ENTROPY SOLUTIONS, LLC. (US) 2016-11-10 — — WO disclosed
US-4456565-A BY REACTING ANHYDRIDE WITH ANHYDROUS HYDROCYANIC ACID BAYER AKTIENGESELLSCHAFT (DE) 1984-06-26 — — US disclosed
US-4455264-A CYANATION OF AN ANHYDRIDE BAYER AKTIENGESELLSCHAFT (DE) 1984-06-19 — — US disclosed
US-4430503-A REACTING A CARBOXYLIC ANHYDRIDE AND TRIMETHYLSILYL CYANIDE BAYER AKTIENGESELLSCHAFT (DE) 1984-02-07 — — US disclosed
US-4360479-A Process for the preparation of acyl cyanide compounds BAYER AKTIENGESELLSCHAFT (DE) 1982-11-23 — — US disclosed
US-4284584-A REACTING AN ANHYDRIDE WITH AN ALKALI METAL CYANIDE BAYER AKTIENGESELLSCHAFT (DE) 1981-08-18 — — US disclosed
US-4238412-A CYANATION OF THE ANHYDRIDE BAYER AKTIENGESELLSCHAFT (DE) 1980-12-09 — — US disclosed