SCHEMBL18544199

SCHEMBL18544199

CCP(Cl)Cl.Clc1ccccc1Pc1ccccc1Cl

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.36
LMNA P02545 1/20 0.36
ADRB2 P07550 1/20 0.33
ADRB1 P08588 1/20 0.33
PNMT P11086 1/20 0.31
IDO1 P14902 1/20 0.31
ALDH1A1 P00352 2/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
TAAR1 Q96RJ0 2/20 0.31

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
SCHEMBL246944 0.82 TSHR (0.53) TSHRLMNAADRB2ADRB1PNMT
Hydrochloric Acid SCHEMBL2155084 0.79 TSHR (0.50) TSHRLMNAADRB2ADRB1PNMT
1,2-Dichlorobenzene SCHEMBL27492790 0.69 TSHR (0.67) TSHRLMNAPNMTIDO1ALDH1A1
Hydrochloric Acid SCHEMBL2154232 0.67 TSHR (0.41) TSHRLMNAPNMTIDO1ALDH1A1
SCHEMBL8013185 0.67 TSHR (0.36) TSHRLMNAADRB2ADRB1ALDH1A1
SCHEMBL4899299 0.66 TSHR (0.45) TSHRLMNAPNMTIDO1ALDH1A1
1,2-Dichlorobenzene SCHEMBL28151921 0.66 TSHR (0.71) TSHRLMNAPNMTIDO1ALDH1A1
1,2-Dichlorobenzene SCHEMBL27583458 0.63 TSHR (0.67) TSHRLMNAPNMTIDO1ALDH1A1
SCHEMBL27879783 0.62
SCHEMBL10712310 0.62 TSHR (0.41) TSHRLMNAADRB2ADRB1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180244865-A1 INCREASED EFFICIENCY DESULFURIZATION REAGENTS ARLANXEO DEUTSCHLAND GMBH (DE) 2018-08-30 US disclosed
EP-3341432-A1 INCREASED EFFICIENCY DESULFURIZATION REAGENTS ARLANXEO Deutschland GmbH (DE) 2018-07-04 EP disclosed
WO-2017036721-A1 INCREASED EFFICIENCY DESULFURIZATION REAGENTS ARLANXEO DEUTSCHLAND GMBH (DE) 2017-03-09 WO disclosed
EP-3135712-A1 INCREASED EFFICIENCY OF DESULFURIZATION REAGENTS ARLANXEO Deutschland GmbH (DE) 2017-03-01 EP disclosed