SCHEMBL4464168

SCHEMBL4464168

CCCCCC[Al+2].CC[O-].CC[O-]

nearest known ligand 0.50

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.50
THRB P10828 1/20 0.50
CES2 O00748 3/20 0.39
CES1 P23141 3/20 0.39
DNM1 Q05193 5/20 0.38
ALDH1A1 P00352 3/20 0.38
LMNA P02545 2/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
HSD17B10 Q99714 1/20 0.38
SLC22A1 O15245 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
SCHEMBL7938582 0.90 TSHR (0.53) TSHRTHRBCES2CES1DNM1
SCHEMBL7024744 0.88 TSHR (0.44) TSHRTHRBCES2CES1DNM1
SCHEMBL11071451 0.88 TSHR (0.44) TSHRTHRBCES2CES1DNM1
SCHEMBL1232118 0.87 TSHR (0.57) TSHRTHRBDNM1ALDH1A1LMNA
Fluoride Ion SCHEMBL11773900 0.87 TSHR (0.57) TSHRTHRBDNM1ALDH1A1LMNA
Hydrochloric Acid SCHEMBL11435761 0.87 TSHR (0.57) TSHRTHRBDNM1ALDH1A1LMNA
Hydrochloric Acid SCHEMBL10520281 0.87 TSHR (0.57) TSHRTHRBDNM1ALDH1A1LMNA
Bromide SCHEMBL1686435 0.87
SCHEMBL151384 0.87
Hydrochloric Acid SCHEMBL6563754 0.87 TSHR (0.57) TSHRTHRBDNM1ALDH1A1LMNA

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
CN-111212856-B Toluene-free silica-supported single-site metallocene catalysts from in situ formation of supported alumoxanes in aliphatic solvents 埃克森美孚化学专利公司 2023-03-24 CN claimed
US-11739169-B2 Solubility improvement of non-metallocene transition metal complexes in aliphatic hydrocarbon solvents EXXONMOBIL CHEMICAL PATENTS INC. (US) 2023-08-29 US disclosed
CN-111212856-B Toluene-free silica-supported single-site metallocene catalysts from in situ formation of supported alumoxanes in aliphatic solvents 埃克森美孚化学专利公司 2023-03-24 CN disclosed
US-20230002514-A1 Supported Non-Coordinating Anion Activators, Use Thereof, and Production Thereof EXXONMOBIL CHEMICAL PATENTS INC (US) 2023-01-05 US disclosed
US-20090189127-A1 Optical resin lens and production method for optical resin material KONICA MINOLTA OTPO, INC. (JP) 2009-07-30 US disclosed
EP-1717607-A1 OPTICAL RESIN LENS AND METHOD FOR PRODUCING OPTICAL RESIN MATERIAL Konica Minolta Opto, Inc. (JP) 2006-11-02 EP disclosed
US-6518375-B1 Trivalent alkyl chromium compound catalyst for the production of an ethylene polymer JAPAN POLYOLEFINS CO., LTD. (JP) 2003-02-11 US disclosed
EP-1041085-B1 Catalyst for the production of ethylene polymer and process for producing ethylene polymer JAPAN POLYOLEFINS CO LTD (JP) 2002-08-14 EP disclosed
EP-1041085-A1 Catalyst for the production of ethylene polymer and process for producing ethylene polymer Japan Polyolefins Co., Ltd. (JP) 2000-10-04 EP disclosed