SCHEMBL7868192

SCHEMBL7868192

O=POC1=CCc2ccccc2O1

nearest known ligand 0.39

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.39
MAOB P27338 1/20 0.39
GAA P10253 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33

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
SCHEMBL5929681 0.80 MAOA (0.43) MAOAMAOBGAANPSR1
SCHEMBL7369195 0.80 MAOA (0.46) MAOAMAOBGAANPSR1
SCHEMBL30920096 0.77 MAOA (0.43) MAOAMAOBGAANPSR1
SCHEMBL6532527 0.77 MAOA (0.43) MAOAMAOBGAANPSR1
SCHEMBL7148896 0.75 MAOA (0.38) MAOAMAOBGAANPSR1
SCHEMBL1925024 0.74 MAOA (0.41) MAOAMAOBGAANPSR1
SCHEMBL14335256 0.72 MAOA (0.39) MAOAMAOBGAANPSR1
SCHEMBL7594758 0.70 TYMS (0.36) MAOAMAOB
SCHEMBL27038377 0.70 SRC (0.36) MAOAMAOBNPSR1
SCHEMBL276959 0.70 MAOA (0.48) MAOAMAOBGAANPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1104405-A1 NEAR INFRARED CHEMILUMINESCENT ACRIDINIUM COMPOUNDS AND USES THEREOF Bayer Corporation (US) 2001-06-06 EP disclosed
WO-2000009487-A9 NEAR INFRARED CHEMILUMINESCENT ACRIDINIUM COMPOUNDS AND USES THEREOF BAYER AG (US) 2000-06-22 WO disclosed
WO-2000009487-A1 NEAR INFRARED CHEMILUMINESCENT ACRIDINIUM COMPOUNDS AND USES THEREOF BAYER CORPORATION (US) 2000-02-24 WO disclosed