SCHEMBL8196326

SCHEMBL8196326

CCCCOCCOCCCl

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.52
CYP3A4 P08684 3/20 0.50
MEN1 O00255 1/20 0.46
THRB P10828 1/20 0.46
HTT P42858 1/20 0.46
KMT2A Q03164 1/20 0.46
MAPT P10636 1/20 0.46
TDP1 Q9NUW8 1/20 0.45
ALDH1A1 P00352 3/20 0.41
ADRB2 P07550 1/20 0.39
ADRB1 P08588 1/20 0.39
ADRB3 P13945 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.38
HPGD P15428 1/20 0.38
RARB P10826 1/20 0.34
CES2 O00748 1/20 0.33

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
SCHEMBL14790872 1.00 TSHR (0.52) TSHRCYP3A4MEN1THRBHTT
SCHEMBL3120108 0.97
SCHEMBL29367393 0.90 HTT (0.60) TSHRCYP3A4MEN1THRBHTT
SCHEMBL8187759 0.90 HTT (0.60) TSHRCYP3A4MEN1THRBHTT
SCHEMBL10878583 0.90 HTT (0.60) TSHRCYP3A4MEN1THRBHTT
SCHEMBL7743538 0.90 HTT (0.60) TSHRCYP3A4MEN1THRBHTT
SCHEMBL7942717 0.89
1,2-Dichloroethane SCHEMBL11148269 0.88 TSHR (0.57) TSHRCYP3A4MEN1THRBHTT
SCHEMBL28055422 0.88 TSHR (0.57) TSHRCYP3A4MEN1THRBHTT
SCHEMBL11788493 0.86 THRB (0.56) TSHRMEN1THRBHTTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0695219-B1 CYCLIC PROCESS FOR ACTIVATION, USE AND RECOVERY OF PHASE-TRANSFER CATALYSTS MINNESOTA MINING & MFG (US) 1997-02-05 EP claimed
EP-0695219-A1 CYCLIC PROCESS FOR ACTIVATION, USE AND RECOVERY OF PHASE-TRANSFER CATALYSTS MINNESOTA MINING & MFG (US) 1996-02-07 EP claimed
US-5483007-A REACTION OF SODIUM THIOCYANATE WITH CHLORIDE COMPOUND IN THE PRESENCE OF A PHASE TRANSFER CATALYST MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1996-01-09 US claimed
WO-1994023837-A1 CYCLIC PROCESS FOR ACTIVATION, USE AND RECOVERY OF PHASE-TRANSFER CATALYSTS MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1994-10-27 WO claimed
EP-2687580-B1 Clock piece BREITLING AG (CH) 2018-04-11 EP disclosed
EP-2687580-A1 Clock piece Breitling AG (CH) 2014-01-22 EP disclosed
EP-0625068-B1 HIGHLY FLUORINATED, CHLORO-SUBSTITUTED ORGANIC COMPOUND-CONTAINING EMULSIONS AND METHODS OF MAKING AND USING THEM HEMAGEN PFC (US) 2000-10-11 EP disclosed
US-5785950-A PERFLUOROBIS(CHLOROBUTYL ETHER; MEDICAL IMAGING HEMAGEN/PFC (US) 1998-07-28 US disclosed
US-5675029-A NUCLEOPHILIC DISPLACEMENT USING PHASE TRANSFER CATALYSIS TO FORM ORGANIC PRODUCT BY REACTING AN ORGANIC REACTANT WITH NUCLEOPHILE WHICH IS DERIVED BY METATHESIS OF CATIONIC PHASE TRANSFER CATALYST QUATERNARY AMMONIUM OR PYRIDINIUM SALTS MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1997-10-07 US disclosed
EP-0695219-B1 CYCLIC PROCESS FOR ACTIVATION, USE AND RECOVERY OF PHASE-TRANSFER CATALYSTS MINNESOTA MINING & MFG (US) 1997-02-05 EP disclosed
EP-0695219-A1 CYCLIC PROCESS FOR ACTIVATION, USE AND RECOVERY OF PHASE-TRANSFER CATALYSTS MINNESOTA MINING & MFG (US) 1996-02-07 EP disclosed
US-5483007-A REACTION OF SODIUM THIOCYANATE WITH CHLORIDE COMPOUND IN THE PRESENCE OF A PHASE TRANSFER CATALYST MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1996-01-09 US disclosed
EP-0625068-A1 HIGHLY FLUORINATED, CHLORO-SUBSTITUTED ORGANIC COMPOUND-CONTAINING EMULSIONS AND METHODS OF MAKING AND USING THEM HEMAGEN/PFC (US) 1994-11-23 EP disclosed
WO-1994023837-A1 CYCLIC PROCESS FOR ACTIVATION, USE AND RECOVERY OF PHASE-TRANSFER CATALYSTS MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1994-10-27 WO disclosed
WO-1993011868-A1 HIGHLY FLUORINATED, CHLORO-SUBSTITUTED ORGANIC COMPOUND-CONTAINING EMULSIONS AND METHODS OF MAKING AND USING THEM HEMAGEN/PFC (US) 1993-06-24 WO disclosed