SCHEMBL9344854

SCHEMBL9344854

NC1(Cl)C=CC(C=Cc2ccccc2)=CC1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 3/20 0.37
CYP19A1 P11511 2/20 0.37
MAOA P21397 2/20 0.37
CHAT P28329 2/20 0.34
GRM4 Q14833 3/20 0.33
NFE2L2 Q16236 2/20 0.33
HDAC6 Q9UBN7 1/20 0.33
KDM1A O60341 2/20 0.33
TTR P02766 1/20 0.33
ALOX5 P09917 1/20 0.33
PTGS1 P23219 1/20 0.33
PTGS2 P35354 1/20 0.33
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
TUBB4A P04350 1/20 0.31
TUBB P07437 1/20 0.31
TUBA3C P0DPH7 1/20 0.31
TUBA1B P68363 1/20 0.31
TUBA4A P68366 1/20 0.31
TUBB4B P68371 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
SCHEMBL28697334 0.88 CHAT (0.35) MAOBCYP19A1MAOACHATGRM4
SCHEMBL4438933 0.83 MAOB (0.39) MAOBCYP19A1MAOACHATGRM4
SCHEMBL7324466 0.82 TRPA1 (0.37) MAOBCYP19A1MAOACHATNFE2L2
Hydrochloric Acid SCHEMBL12003783 0.81 MAOB (0.38) MAOBCYP19A1MAOACHATGRM4
Water SCHEMBL27514626 0.81 MAOB (0.38) MAOBCYP19A1MAOACHATGRM4
SCHEMBL27693757 0.80 MAOB (0.37) MAOBCYP19A1MAOACHATGRM4
SCHEMBL29136474 0.78 TRPA1 (0.38) CHATNFE2L2TTRALOX5PTGS1
SCHEMBL17650863 0.78 NFE2L2 (0.33) MAOBCYP19A1MAOACHATNFE2L2
SCHEMBL6837817 0.78 CHAT (0.35) MAOBCYP19A1MAOACHATNFE2L2
SCHEMBL31506486 0.78 CHAT (0.35) MAOBCYP19A1MAOACHATNFE2L2

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
US-5342904-A Polymer modified adducts of epoxy resins and active hydrogen containing compounds containing mesogenic moieties THE DOW CHEMICAL COMPANY (US) 1994-08-30 US claimed