SCHEMBL6666467

SCHEMBL6666467

Fc1ccccc1-c1cc(-c2ccccc2)nc2cccc(F)c12

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TOP1 P11387 4/20 0.44
ACHE P22303 1/20 0.44
SMN1; SMN2 Q16637 5/20 0.43
ABCG2 Q9UNQ0 1/20 0.43
LMNA P02545 3/20 0.41
HPGD P15428 3/20 0.41
KDM4E B2RXH2 2/20 0.41
NPC1 O15118 2/20 0.41
MEN1 O00255 1/20 0.41
PKM P14618 1/20 0.41
NFKB1 P19838 1/20 0.41
MAPK1 P28482 1/20 0.41
RAB9A P51151 1/20 0.41
NFKB2 Q00653 1/20 0.41
KMT2A Q03164 1/20 0.41
RELA Q04206 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
PDE10A Q9Y233 1/20 0.41
ALDH1A1 P00352 1/20 0.40
MAPT P10636 1/20 0.40

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
SCHEMBL6663078 0.87 TOP1 (0.43) TOP1SMN1; SMN2HPGDKDM4ENPC1
SCHEMBL6659626 0.84 TOP1 (0.59) TOP1ABCG2HPGDKDM4EMAPK1
SCHEMBL28252108 0.83 ACHE (0.54) TOP1ACHESMN1; SMN2ABCG2LMNA
SCHEMBL732138 0.81 TOP1 (0.50) TOP1ACHESMN1; SMN2LMNAHPGD
SCHEMBL739152 0.78 DHODH (0.49) TOP1ACHESMN1; SMN2LMNAHPGD
SCHEMBL30524994 0.75 MEN1 (0.51) SMN1; SMN2LMNAHPGDKDM4ENPC1
SCHEMBL730507 0.75 TOP1 (0.52) TOP1SMN1; SMN2ABCG2HPGDKDM4E
SCHEMBL20809066 0.74 PTGER4 (0.46) TOP1ACHESMN1; SMN2ABCG2LMNA
SCHEMBL8956150 0.74 MAPK1 (0.63) SMN1; SMN2ABCG2LMNAHPGDKDM4E
SCHEMBL6660161 0.74 ESR1 (0.65) MEN1KMT2AELANE

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
EP-0861864-B1 Method of preparation of polyquinolines HITACHI CHEMICAL CO LTD (JP) 2004-08-25 EP disclosed
EP-0861864-A2 Method of preparation of polyquinolines HITACHI CHEMICAL CO., LTD. (JP) 1998-09-02 EP disclosed
US-5786071-A Method of preparation of polyquinolines HITACHI CHEMICAL COMPANY, LTD. (JP) 1998-07-28 US disclosed
US-5648448-A Method of preparation of polyquinolines HITACHI CHEMICAL COMPANY, LTD. (JP) 1997-07-15 US disclosed