SCHEMBL28126276

SCHEMBL28126276

CCOC(=O)c1c(Br)nc2ccccc2c1O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.55
LMNA P02545 3/20 0.55
MEN1 O00255 2/20 0.55
KMT2A Q03164 2/20 0.55
KDM4E B2RXH2 7/20 0.54
ALDH1A1 P00352 5/20 0.54
MAPT P10636 3/20 0.52
RECQL P46063 1/20 0.50
GAA P10253 2/20 0.49
HPGD P15428 2/20 0.49
NPC1 O15118 1/20 0.49
RAB9A P51151 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49
GLA P06280 1/20 0.48
POLB P06746 1/20 0.48
CA12 O43570 1/20 0.47
CA1 P00915 1/20 0.47
CA2 P00918 1/20 0.47
CA7 P43166 1/20 0.47
CA9 Q16790 1/20 0.47

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
SCHEMBL25082363 0.87 SMN1; SMN2 (0.66) SMN1; SMN2LMNAMEN1KMT2AKDM4E
SCHEMBL538291 0.86 SMN1; SMN2 (0.69) SMN1; SMN2LMNAMEN1KMT2AKDM4E
SCHEMBL27659536 0.86 SMN1; SMN2 (0.58) SMN1; SMN2LMNAMEN1KMT2AKDM4E
SCHEMBL29860485 0.86 SMN1; SMN2 (0.58) SMN1; SMN2LMNAMEN1KMT2AKDM4E
SCHEMBL9607221 0.85 KDM4E (0.56) SMN1; SMN2LMNAMEN1KMT2AKDM4E
SCHEMBL31440795 0.85 KDM4E (0.56) SMN1; SMN2LMNAMEN1KMT2AKDM4E
SCHEMBL14238204 0.83 SMN1; SMN2 (0.55) SMN1; SMN2LMNAMEN1KMT2AKDM4E
SCHEMBL11075264 0.83 KDM4E (0.61) SMN1; SMN2LMNAMEN1KMT2AKDM4E
SCHEMBL27327783 0.83 KDM4E (0.57) SMN1; SMN2LMNAMEN1KMT2AKDM4E
SCHEMBL27276256 0.83 SMN1; SMN2 (0.55) SMN1; SMN2LMNAMEN1KMT2AKDM4E

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
CN-106432073-B A kind of preparation method of the bromo- 4- chloroquinoline of 6- 上海再启生物技术有限公司 2018-12-21 CN disclosed
CN-106432073-A 6-bromo-4-chloroquinoline preparation method 上海再启生物技术有限公司 2017-02-22 CN disclosed