SCHEMBL10897403

SCHEMBL10897403

[CH2]CC=CCCCCc1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ MAOA P21397 1/20 0.47
▸ MAOB P27338 2/20 0.45
▸ TRPV1 Q8NER1 1/20 0.45
▸ SIGMAR1 Q99720 5/20 0.44
▸ L3MBTL1 Q9Y468 1/20 0.42

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
SCHEMBL10897398 1.00 MAOA (0.47) MAOAMAOBTRPV1SIGMAR1L3MBTL1
SCHEMBL10889939 0.98 TRPV1 (0.48) MAOAMAOBTRPV1SIGMAR1
SCHEMBL10895606 0.98 TRPV1 (0.48) MAOAMAOBTRPV1SIGMAR1
SCHEMBL10889936 0.98 TRPV1 (0.48) MAOAMAOBTRPV1SIGMAR1
SCHEMBL10895596 0.98 TRPV1 (0.48) MAOAMAOBTRPV1SIGMAR1
SCHEMBL11006778 0.86 TRPV1 (0.48) MAOAMAOBTRPV1SIGMAR1
SCHEMBL97474 0.85 GPR52 (0.48) MAOB
SCHEMBL97473 0.85 GPR52 (0.48) MAOB
SCHEMBL28645454 0.82 MAOB (0.62) MAOAMAOBTRPV1SIGMAR1L3MBTL1
SCHEMBL1045005 0.80 TRPV1 (0.49) MAOAMAOBTRPV1SIGMAR1

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
US-4605645-A ANTITUMOR AGENTS TEIJIN LIMITED (JP) 1986-08-12 — — US disclosed
EP-0081386-B1 5-FLUORO-2'-DEOXYURIDINE DERIVATIVES AND A PROCESS FOR THE PREPARATION THEREOF TEIJIN LIMITED (JP) 1985-05-29 — — EP disclosed
EP-0081386-A1 5-Fluoro-2'-deoxyuridine derivatives and a process for the preparation thereof TEIJIN LIMITED (JP) 1983-06-15 — — EP disclosed
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