SCHEMBL8970933

SCHEMBL8970933

ClC(c1ccccc1)(c1ccccc1)C1c2ccccc2-c2ccccc21

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.42
CYP1A2 P05177 3/20 0.35
GPR3 P46089 2/20 0.35
HTR2A P28223 1/20 0.35
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
ATM Q13315 2/20 0.32
SLC22A2 O15244 1/20 0.32
SLC22A3 O75751 1/20 0.32
POLB P06746 1/20 0.32
ALDH1A1 P00352 2/20 0.32
KCNN4 O15554 1/20 0.32
HDAC3 O15379 1/20 0.31
HDAC4 P56524 1/20 0.31
HDAC7 Q8WUI4 1/20 0.31
HDAC8 Q9BY41 1/20 0.31
HDAC6 Q9UBN7 1/20 0.31
HDAC9 Q9UKV0 1/20 0.31
HDAC5 Q9UQL6 1/20 0.31
NCOR2 Q9Y618 1/20 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
SCHEMBL8970174 0.79 TSHR (0.39) TSHRCYP1A2GPR3HTR2AMEN1
SCHEMBL1539669 0.77 GPR3 (0.38) TSHRCYP1A2GPR3HTR2AMEN1
SCHEMBL12815225 0.77 GPR3 (0.38) TSHRCYP1A2GPR3HTR2AMEN1
SCHEMBL12815279 0.74 GPR3 (0.40) GPR3HTR2AMEN1KMT2AATM
SCHEMBL8971042 0.73 GPR3 (0.43) CYP1A2GPR3HTR2AMEN1KMT2A
SCHEMBL12815139 0.71 ALDH1A1 (0.38) TSHRCYP1A2GPR3HTR2AMEN1
SCHEMBL21758197 0.71 CYP1A2 (0.42) TSHRCYP1A2KMT2APOLBHDAC3
SCHEMBL28838079 0.68 KCNN4 (0.32) GPR3HTR2AKCNN4
SCHEMBL3922127 0.67 GPR3 (0.46) CYP1A2GPR3HTR2AMEN1KMT2A
SCHEMBL5837267 0.67 GPR3 (0.46) CYP1A2GPR3HTR2AMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5492974-A Process for preparing polymer bound metallocenes PHILLIPS PETROLEUM COMPANY (US) 1996-02-20 US disclosed
US-5492978-A Process for preparing catalyst system PHILLIPS PETROLEUM COMPANY (US) 1996-02-20 US disclosed
US-5492973-A Polymer bound ligands PHILLIPS PETROLEUM COMPANY (US) 1996-02-20 US disclosed
US-5492985-A Polymerization processes PHILLIPS PETROLEUM COMPANY (US) 1996-02-20 US disclosed
US-5492975-A Polymer bound metallocenes PHILLIPS PETROLEUM COMPANY (US) 1996-02-20 US disclosed
EP-0690076-A1 Polymer bound ligands, polymer bound metallocenes, catalyst systems, preparation, and use PHILLIPS PETROLEUM COMPANY (US) 1996-01-03 EP disclosed
US-5473020-A Polymer bound ligands, polymer bound metallocenes, catalyst systems, preparation, and use PHILLIPS PETROLEUM COMPANY (US) 1995-12-05 US disclosed