SCHEMBL28812271

SCHEMBL28812271

Cc1[nH]c(Cc2ccc(Cl)cc2Cl)nc1-c1cccc(Cl)c1Cl

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 2/20 0.46
HTT P42858 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
LMNA P02545 3/20 0.38
NPSR1 Q6W5P4 1/20 0.38
KDM4E B2RXH2 2/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
CRHR1 P34998 2/20 0.37
NUDT1 P36639 1/20 0.37
MAPT P10636 1/20 0.36
RAB9A P51151 1/20 0.35
EGFR P00533 1/20 0.35
ERBB2 P04626 1/20 0.35
CYP2D6 P10635 1/20 0.35
MAOA P21397 1/20 0.35
MAPK1 P28482 1/20 0.35
ADRA1A P35348 1/20 0.35
SCN4A P35499 1/20 0.35
BLM P54132 1/20 0.35
PMP22 Q01453 1/20 0.35

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
SCHEMBL27967890 0.90 P2RX7 (0.46) P2RX7LMNAKDM4ECRHR1NUDT1
SCHEMBL26111667 0.90 HTT (0.43) P2RX7HTTSMN1; SMN2LMNANPSR1
SCHEMBL2867291 0.87 KDM4E (0.48) P2RX7SMN1; SMN2LMNAKDM4ENUDT1
SCHEMBL27915185 0.87 HTT (0.42) HTTSMN1; SMN2LMNANPSR1KDM4E
SCHEMBL27967808 0.86 HTT (0.44) HTTSMN1; SMN2LMNANPSR1KDM4E
SCHEMBL2868868 0.86 SMN1; SMN2 (0.46) HTTSMN1; SMN2LMNANPSR1KDM4E
SCHEMBL28812708 0.86 P2RX7 (0.40) P2RX7SMN1; SMN2LMNAKDM4ENUDT1
SCHEMBL29889983 0.86 SMN1; SMN2 (0.46) HTTSMN1; SMN2LMNANPSR1KDM4E
SCHEMBL31305581 0.85 CRHR1 (0.40) P2RX7LMNAKDM4ECRHR1MAPT
SCHEMBL3421965 0.85 CRHR1 (0.40) P2RX7LMNAKDM4ECRHR1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102119240-B Surface treating agent for copper or copper alloy and use thereof SHIKOKU CHEM 2014-07-30 CN disclosed