SCHEMBL9066754

SCHEMBL9066754

C[CH]Oc1ccc(Br)c2ccccc12

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PKM P14618 1/20 0.49
L3MBTL1 Q9Y468 2/20 0.45
LMNA P02545 1/20 0.45
GPR84 Q9NQS5 1/20 0.37
RXFP1 Q9HBX9 2/20 0.37
IMPDH2 P12268 1/20 0.35
IMPDH1 P20839 1/20 0.35
AAK1 Q2M2I8 1/20 0.35
IDO1 P14902 1/20 0.34
EP300 Q09472 1/20 0.33
KAT8 Q9H7Z6 1/20 0.33
NQO2 P16083 1/20 0.33
MAPK10 P53779 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
HTR6 P50406 1/20 0.33
KMT2A Q03164 2/20 0.32
EPHX1 P07099 1/20 0.32
HPGD P15428 1/20 0.32
HPGDS O60760 1/20 0.31
MAPT P10636 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
SCHEMBL30719614 0.77 IDO1 (0.57) PKML3MBTL1LMNAIMPDH2IMPDH1
SCHEMBL1891196 0.77 IDO1 (0.57) PKML3MBTL1LMNAIMPDH2IMPDH1
SCHEMBL11068046 0.76 PKM (0.52) PKML3MBTL1LMNAGPR84RXFP1
SCHEMBL9067780 0.76 CYP1A2 (0.52) L3MBTL1LMNAGPR84NPSR1KMT2A
SCHEMBL7527797 0.75 IDO1 (0.55) PKML3MBTL1LMNAIMPDH2IMPDH1
SCHEMBL1223374 0.74 HTR7 (0.42) L3MBTL1LMNAKMT2AHPGDMAPT
SCHEMBL30710586 0.72 RXFP1 (0.48) PKML3MBTL1LMNARXFP1HTR6
SCHEMBL198796 0.72 RXFP1 (0.48) PKML3MBTL1LMNARXFP1HTR6
SCHEMBL29429114 0.72 RXFP1 (0.48) PKML3MBTL1LMNARXFP1HTR6
SCHEMBL9066758 0.72 LMNA (0.53) PKML3MBTL1LMNAGPR84AAK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0441383-B1 Use of a copolymer for the making of contact lenses MITSUBISHI RAYON CO (JP) 1996-05-08 EP disclosed
US-5183870-A A curable polybutylene glycol di(meth)acrylate, a urethane or epoxy (meth)acrylate and a (meth)acrylate; heat and water resistance; impact strength; dyeability; workability MITSUBISHI RAYON CO., LTD (JP) 1993-02-02 US disclosed
EP-0441383-A2 Use of a copolymer for the making of contact lenses MITSUBISHI RAYON CO., LTD. (JP) 1991-08-14 EP disclosed