SCHEMBL11206268

SCHEMBL11206268

COc1ccc(C2CC(C#N)CCC2=O)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DDB1 Q16531 1/20 0.47
CRBN Q96SW2 1/20 0.47
GAA P10253 4/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
BLM P54132 1/20 0.40
SLC6A4 P31645 1/20 0.39
HRH3 Q9Y5N1 1/20 0.39
MMP1 P03956 1/20 0.39
MMP13 P45452 1/20 0.39
KDM1A O60341 2/20 0.38
MAOA P21397 1/20 0.38
MAOB P27338 1/20 0.38
ALDH1A1 P00352 3/20 0.37
CYP19A1 P11511 1/20 0.37
MAP2K3 P46734 1/20 0.37
MAPK1 P28482 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
KDM4E B2RXH2 2/20 0.36
NPSR1 Q6W5P4 1/20 0.36

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
SCHEMBL8018754 0.85 ALDH1A1 (0.45) CRBNGAAMAOAMAOBALDH1A1
SCHEMBL11093631 0.82 ALDH1A1 (0.42) GAAMEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL11099324 0.81 SRD5A1 (0.38) GAAKMT2ASLC6A4ALDH1A1CYP19A1
SCHEMBL7532311 0.76 PDE4B (0.40) SLC6A4ALDH1A1SMN1; SMN2
SCHEMBL7559949 0.75 PDE4B (0.52)
SCHEMBL11637205 0.73 DDB1 (0.55) DDB1CRBNMEN1KMT2AMMP1
SCHEMBL15874734 0.72 MAPK1 (0.56) DDB1CRBNGAAMEN1KMT2A
SCHEMBL318066 0.72 MAPK1 (0.56) DDB1CRBNGAAMEN1KMT2A
SCHEMBL10177643 0.72 GAA (0.42) GAAMEN1KMT2ABLMKDM1A
SCHEMBL11873333 0.71 MAPK1 (0.55) DDB1CRBNMEN1KMT2AALDH1A1

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-0073849-A1 Novel phenyl-1,2,3,4-tetrahydrocarbazoles, their preparation and pharmaceutical compositions containing them SCHERING CORPORATION (US) 1983-03-16 EP disclosed
US-4292323-A Phenyl-1,2,3,4-tetrahydrocarbazoles and use thereof SCHERING CORPORATION (US) 1981-09-29 US disclosed