SCHEMBL8648306

SCHEMBL8648306

Cc1ccc(C2C[N]CCS2)cc1

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.41
MAOA P21397 2/20 0.33
KDM4E B2RXH2 1/20 0.32
BCHE P06276 1/20 0.31
NISCH Q9Y2I1 1/20 0.31
MAOB P27338 1/20 0.30
HTR2A P28223 1/20 0.30
HTR2C P28335 1/20 0.30
HTR2B P41595 1/20 0.30

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
SCHEMBL8648816 0.81 MAPT (0.41) MAPTKDM4EMAOBHTR2CHTR2B
SCHEMBL7297943 0.81 KDM1A (0.34) MAPTKDM4EBCHEHTR2AHTR2C
SCHEMBL8647431 0.81 LMNA (0.33) KDM4EHTR2AHTR2CHTR2B
SCHEMBL4175988 0.81 BRD4 (0.34) MAPTMAOANISCHMAOB
SCHEMBL9358742 0.71 MAPT (0.44) MAPTMAOAKDM4EMAOBHTR2A
SCHEMBL5110375 0.71 MAPT (0.47) MAPTKDM4EBCHEHTR2AHTR2C
SCHEMBL1366298 0.67 SLC18A3 (0.38) MAPTHTR2AHTR2CHTR2B
SCHEMBL12015997 0.67 MAOA (0.68) MAPTMAOAKDM4EMAOB
SCHEMBL12016000 0.66 MAPT (0.40) MAPT
SCHEMBL5132106 0.65 MAPT (0.50) MAPTKDM4EHTR2AHTR2CHTR2B

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-5773437-A UROGENITAL DISORDERS SUCH AS DYSURIA NIPPON CHEMIPHAR CO., LTD. (JP) 1998-06-30 US disclosed