SCHEMBL28115384

SCHEMBL28115384

Cc1ccc2c(c1)C(Cl)=CC2

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
METAP1 P53582 3/20 0.39
ACHE P22303 2/20 0.39
PARP10 Q53GL7 2/20 0.38
PARP1 P09874 1/20 0.38
ADORA1 P30542 1/20 0.36
CYP19A1 P11511 2/20 0.33
CYP11B2 P19099 2/20 0.33
MAOA P21397 1/20 0.33
MAOB P27338 1/20 0.33
ELANE P08246 1/20 0.32
CYP1A2 P05177 2/20 0.32
CYP2A6 P11509 2/20 0.32
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
POLB P06746 1/20 0.31
GAA P10253 1/20 0.31
MAPT P10636 1/20 0.31
PKM P14618 1/20 0.31
RAB9A P51151 1/20 0.31
SMN1; SMN2 Q16637 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
SCHEMBL8354288 0.83 METAP1 (0.39) METAP1ACHEPARP10PARP1MAOA
SCHEMBL30933590 0.78 METAP1 (0.41) METAP1ACHEPARP10PARP1ADORA1
SCHEMBL9629516 0.78 METAP1 (0.41) METAP1ACHEPARP10PARP1ADORA1
SCHEMBL28115385 0.75 METAP1 (0.39) METAP1ACHEPARP10PARP1ADORA1
SCHEMBL8344964 0.72 METAP1 (0.53) METAP1ACHEPARP10PARP1ADORA1
SCHEMBL17073935 0.69 HTR6 (0.40) ACHEMAOAMAOBCYP2A6MAPT
SCHEMBL20219239 0.68 HTR7 (0.39) METAP1ACHEPARP10PARP1ADORA1
SCHEMBL11768880 0.68 HTR7 (0.49) METAP1ACHEPARP10PARP1ADORA1
SCHEMBL29633503 0.67 METAP1 (0.57) METAP1ACHEPARP10PARP1ADORA1
SCHEMBL546147 0.67 METAP1 (0.57) METAP1ACHEPARP10PARP1ADORA1

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-106349150-A Method for synthesizing indene (1,2-b) indole-10(5H)-ketone compounds 河南师范大学 2017-01-25 CN disclosed