SCHEMBL9066864

SCHEMBL9066864

COC[CH]Oc1c(Cl)cc(Cl)cc1Cl

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.35
MAPT P10636 4/20 0.35
TDP1 Q9NUW8 2/20 0.35
CYP1A2 P05177 3/20 0.35
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
CA9 Q16790 1/20 0.34
L3MBTL1 Q9Y468 3/20 0.34
ALDH1A1 P00352 3/20 0.34
HPGD P15428 2/20 0.34
KDM4E B2RXH2 1/20 0.34
TSHR P16473 1/20 0.34
HSD17B10 Q99714 1/20 0.34
MEN1 O00255 3/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
CYP2D6 P10635 2/20 0.33
CYP2C9 P11712 1/20 0.33
LMNA P02545 2/20 0.32
CYP2C19 P33261 1/20 0.32
HTT P42858 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
SCHEMBL10507012 0.79 CA1 (0.36) KMT2AMAPTTDP1CYP1A2CA1
SCHEMBL1764467 0.72 CA1 (0.40) KMT2AMAPTTDP1CYP1A2CA1
SCHEMBL10578381 0.71 GALK1 (0.37) MAPTTDP1TSHRPOLB
SCHEMBL54507 0.68 KMT2A (0.47) KMT2AMAPTTDP1CYP1A2CA1
SCHEMBL3390853 0.67 CA1 (0.40) MAPTCA1CA2CA9L3MBTL1
SCHEMBL95387 0.67 CA1 (0.45) KMT2AMAPTTDP1CYP1A2CA1
SCHEMBL11783352 0.67 CA1 (0.41) TDP1CYP1A2CA1CA2CA9
SCHEMBL14612615 0.65 KMT2A (0.54) KMT2AMAPTTDP1CYP1A2CA1
SCHEMBL13182675 0.64 NPC1 (0.41) KMT2AMAPTTDP1CYP1A2CA1
SCHEMBL3351146 0.64 NPC1 (0.41) KMT2AMAPTTDP1CYP1A2CA1

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