SCHEMBL4086875

SCHEMBL4086875

Cc1cc(C)cc(OB(O)O)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.41
TSHR P16473 2/20 0.41
CYP3A4 P08684 1/20 0.41
MAPK1 P28482 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.38
NPSR1 Q6W5P4 1/20 0.34
TPMT P51580 1/20 0.33
TP53 P04637 1/20 0.32
ALOX15 P16050 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
POLB P06746 1/20 0.32
CYP2C9 P11712 1/20 0.32
PRSS1 P07477 1/20 0.32
PRSS2 P07478 1/20 0.32
C1S P09871 1/20 0.32
PRSS3 P35030 1/20 0.32
SELL P14151 1/20 0.32
SELP P16109 1/20 0.32

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
SCHEMBL27831721 0.97 ALDH1A1 (0.39) ALDH1A1TSHRCYP3A4MAPK1TDP1
SCHEMBL27811325 0.97 ALDH1A1 (0.39) ALDH1A1TSHRCYP3A4MAPK1TDP1
Ammonia Solution, Strong SCHEMBL29088797 0.97 ALDH1A1 (0.39) ALDH1A1TSHRCYP3A4MAPK1TDP1
SCHEMBL29112060 0.86 ALDH1A1 (0.33) ALDH1A1TSHRCYP3A4MAPK1TDP1
SCHEMBL29706573 0.86 ALDH1A1 (0.33) ALDH1A1TSHRCYP3A4MAPK1TDP1
SCHEMBL22769689 0.86 ALDH1A1 (0.48) ALDH1A1CYP3A4ALOX15CYP2C9ACHE
SCHEMBL31300184 0.84 RAPGEF4 (0.31) ALDH1A1TSHRCYP3A4MAPK1TDP1
SCHEMBL630367 0.84 ALDH1A1 (0.41) ALDH1A1TSHRCYP3A4MAPK1TDP1
Propylene Glycol SCHEMBL28899293 0.84 TDP1 (0.37) ALDH1A1TSHRCYP3A4MAPK1TDP1
SCHEMBL30532200 0.81 RXRA (0.37) ALDH1A1TSHRSMN1; SMN2POLBCYP2C9

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 190 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105949245-A Yellow light emitting iridium phosphorescence coordination compound and method for preparing same 昆明贵金属研究所 2016-09-21 CN claimed
CN-103012623-B Metalloscene catalyst, its synthesis and purposes in olefin polymerization NOVOLEN TECH HOLDINGS CV (DE) 2015-09-16 CN claimed
CN-101432317-B Polymerization catalysts for producing polymers with low levels of long chain branching CHEVRON PHILLIPS CHEMICAL CO 2013-11-13 CN claimed
EP-1506176-B1 AMINOINDAZOLE DERIVATIVES ACTIVE AS KINASE INHIBITORS, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS COMPRISING THEM PFIZER ITALIA SRL (IT) 2013-04-24 EP claimed
CN-103012623-A Metallocene catalysts, their synthesis and their use for the polymerization of olefins NOVOLEN TECH HOLDINGS CV 2013-04-03 CN claimed
CN-103012497-A Nano-linked metallocene catalyst compositions and their polymer products CHEVRON PHILLIPS CHEMICAL CO 2013-04-03 CN claimed
CN-102875604-A Nano-linked metallocene catalyst compositions and their polymer products CHEVRON PHILLIPS CHEMICAL CO 2013-01-16 CN claimed
CN-101400709-B Polymerization catalysts for producing polymers with low levels of long chain branching CHEVRON PHILLIPS CHEMICAL CO 2012-07-18 CN claimed
CN-101006105-B Polymerization catalysts for producing polymers with low levels of long chain branching CHEVRON PHILLIPS CHEMICAL CO 2011-09-21 CN claimed
CN-101910216-A Racemoselective synthesis of ansa-metallocene compounds, catalysts containing the same, process for preparing olefin polymers by using the catalysts and olefin homopolymers and copolymers NOVOLEN TECH HOLDINGS CV 2010-12-08 CN claimed
CN-100562532-C Dual metallocene catalyst for producing film resins with excellent Machine Direction (MD) Elmendorf tear strength CHEVRON PHILLIPS CHEMICAL CO (US) 2009-11-25 CN claimed
EP-1778749-A2 POLYMERIZATION CATALYSTS FOR PRODUCING POLYMERS WITH LOW LEVELS OF LONG CHAIN BRANCHING Chevron Phillips Chemical Company LP (US) 2007-05-02 EP claimed
WO-2006004709-A2 POLYMERIZATION CATALYSTS FOR PRODUCING POLYMERS WITH LOW LEVELS OF LONG CHAIN BRANCHING CHEVRON PHILLIPS CHEMICAL COMPANY, LP (US) 2006-01-12 WO claimed
CN-1527842-A Catalyst system and its use in a polymerization process �������ٶ������������ι�˾ 2004-09-08 CN claimed
CN-1240796-A Ethylene polymers with alpha-olefins SIAC IT ADDITIVI CARBURANTI (IT) 2000-01-12 CN claimed
US-12398338-B2 Viscosity modifier for lubricating oil and lubricating oil composition for hydraulic fluid MITSUI CHEMICALS, INC. (JP) 2025-08-26 US disclosed
CN-116333000-B Organometallic compound and organic light emitting diode including the same 乐金显示有限公司 2025-05-06 CN disclosed
CN-1077578-C Olefin polymerization catalyst with multidentate ligand ASAHI CHEMICAL IND (JP) 2002-01-09 CN disclosed
EP-0574794-B1 Organic transition metal compound having a pi-bonding heterocyclic ligand and method of polymerizing olefins by using the same TOSOH CORP (JP) 2000-09-06 EP disclosed
EP-0574794-A1 Organic transition metal compound having a pi-bonding heterocyclic ligand and method of polymerizing olefins by using the same TOSOH CORPORATION (JP) 1993-12-22 EP disclosed