SCHEMBL8497072

SCHEMBL8497072

[CH2]CCCCCCCCCCCCCCCCCCCCCCCCCc1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ SIGMAR1 Q99720 11/20 0.58
▸ MAOA P21397 1/20 0.56
▸ MAOB P27338 2/20 0.54
▸ MAPT P10636 1/20 0.54
▸ RXFP1 Q9HBX9 1/20 0.54
▸ L3MBTL1 Q9Y468 1/20 0.50

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
SCHEMBL8499471 1.00 SIGMAR1 (0.58) SIGMAR1MAOAMAOBMAPTRXFP1
SCHEMBL303522 1.00 SIGMAR1 (0.58) SIGMAR1MAOAMAOBMAPTRXFP1
SCHEMBL8496647 1.00 SIGMAR1 (0.58) SIGMAR1MAOAMAOBMAPTRXFP1
SCHEMBL273088 1.00 SIGMAR1 (0.58) SIGMAR1MAOAMAOBMAPTRXFP1
SCHEMBL8496345 1.00 SIGMAR1 (0.58) SIGMAR1MAOAMAOBMAPTRXFP1
SCHEMBL302640 1.00 SIGMAR1 (0.58) SIGMAR1MAOAMAOBMAPTRXFP1
SCHEMBL302972 1.00 SIGMAR1 (0.58) SIGMAR1MAOAMAOBMAPTRXFP1
SCHEMBL272185 1.00 SIGMAR1 (0.58) SIGMAR1MAOAMAOBMAPTRXFP1
SCHEMBL303165 1.00 SIGMAR1 (0.58) SIGMAR1MAOAMAOBMAPTRXFP1
SCHEMBL302914 1.00 SIGMAR1 (0.58) SIGMAR1MAOAMAOBMAPTRXFP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5952316-A FOR TREATING AUTOIMMUNE DISEASES, E.G., RHEUMATIOD ARTHRITIS YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1999-09-14 — — US disclosed
EP-0627406-B1 2-AMINO-1,3-PROPANEDIOL COMPOUND AND IMMUNOSUPPRESSANT YOSHITOMI PHARMACEUTICAL (JP) 1998-10-28 — — EP disclosed
US-5719176-A 2-amino-1,3-propanediol compound and immunosuppressant YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1998-02-17 — — US disclosed
US-5604229-A 2-amino-1,3-propanediol compound and immunosuppressant YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1997-02-18 — — US disclosed
EP-0627406-A1 2-AMINO-1,3-PROPANEDIOL COMPOUND AND IMMUNOSUPPRESSANT YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1994-12-07 — — EP disclosed
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