SCHEMBL8971108

SCHEMBL8971108

O=C(C[n+]1cccc(Cl)c1)Oc1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATM Q13315 3/20 0.39
PABPC1 P11940 2/20 0.39
KMT2A Q03164 2/20 0.39
CYP19A1 P11511 1/20 0.39
GLA P06280 1/20 0.38
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 1/20 0.36
LMNA P02545 1/20 0.36
HTT P42858 1/20 0.36
ELANE P08246 1/20 0.36
HSP90AA1 P07900 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
MAPT P10636 1/20 0.35
PTK2B Q14289 1/20 0.35
TAAR1 Q96RJ0 1/20 0.35
PRSS1 P07477 1/20 0.35
PRSS2 P07478 1/20 0.35
PRSS3 P35030 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
BCHE P06276 1/20 0.34

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
SCHEMBL8971256 0.92 ALDH1A1 (0.36) ATMPABPC1KMT2ACYP19A1GLA
SCHEMBL8971369 0.82 KDM4E (0.46) ATMPABPC1KMT2ACYP19A1KDM4E
Chlorobenzene SCHEMBL28289913 0.70 ELANE (0.62) KMT2ACYP19A1KDM4ELMNAHTT
Bromide SCHEMBL11490662 0.69 ALDH1A1 (0.44) ATMPABPC1KMT2AGLAKDM4E
SCHEMBL137047 0.67 CYP19A1 (0.52) ATMKMT2ACYP19A1KDM4EALDH1A1
Chlorobenzene SCHEMBL6386765 0.67 TSHR (0.50) ATMKMT2AKDM4EALDH1A1LMNA
SCHEMBL43742 0.66 KMT2A (0.61) ATMKMT2ACYP19A1KDM4EALDH1A1
SCHEMBL153387 0.66 CYP19A1 (0.55) ATMKMT2ACYP19A1KDM4EALDH1A1
SCHEMBL17717505 0.66 CYP19A1 (0.47) ATMKMT2ACYP19A1ALDH1A1LMNA
Iodide SCHEMBL11697804 0.66 PABPC1 (0.59) ATMPABPC1KMT2AGLAKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0548348-B1 TONERS AND DEVELOPERS CONTAINING ESTER-CONTAINING QUATERNARY PYRIDINIUM SALTS AS CHARGE CONTROL AGENTS EASTMAN KODAK CO (US) 1996-03-20 EP claimed
WO-1993002053-A1 ESTER-CONTAINING QUATERNARY PYRIDINIUM SALTS EASTMAN KODAK COMPANY (US) 1993-02-04 WO claimed