SCHEMBL13052506

SCHEMBL13052506

CN1C=C/C(=C\c2sc3ccc(SOOO)cc3[n+]2C)c2ccccc21

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.42
▸ POLB P06746 2/20 0.42
▸ MAPT P10636 2/20 0.42
▸ KMT2A Q03164 2/20 0.42
▸ SMN1; SMN2 Q16637 2/20 0.42
▸ NPSR1 Q6W5P4 2/20 0.42
▸ KDM4E B2RXH2 1/20 0.42
▸ NPC1 O15118 1/20 0.42
▸ ALDH1A1 P00352 1/20 0.42
▸ HTT P42858 1/20 0.42
▸ RAB9A P51151 1/20 0.42
▸ BLM P54132 1/20 0.42
▸ MCL1 Q07820 1/20 0.42
▸ THRB P10828 1/20 0.32
▸ RECQL P46063 1/20 0.32

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
SCHEMBL13052513 0.86 — —
SCHEMBL13388979 0.81 RAB9A (0.57) MEN1POLBMAPTKMT2ASMN1; SMN2
SCHEMBL168807 0.81 RAB9A (0.57) MEN1POLBMAPTKMT2ASMN1; SMN2
SCHEMBL13052521 0.78 POLB (0.44) MEN1POLBMAPTKMT2ASMN1; SMN2
SCHEMBL13052505 0.78 — —
SCHEMBL12302037 0.74 KDM4E (0.47) MEN1POLBMAPTKMT2ASMN1; SMN2
SCHEMBL13052514 0.74 POLB (0.32) MEN1POLBMAPTKMT2ASMN1; SMN2
SCHEMBL13052550 0.72 — —
SCHEMBL12302000 0.71 KDM4E (0.42) MEN1POLBMAPTKMT2ASMN1; SMN2
SCHEMBL14982709 0.70 INSR (0.45) MEN1POLBMAPTKMT2ASMN1; SMN2

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-7842811-B2 Cyanine dye compounds Life Technologies Corporation (US) 2010-11-30 — — US disclosed
US-20100120051-A1 CYANINE DYE COMPOUNDS Life Technologies Corporation (US) 2010-05-13 — — US disclosed
US-7655409-B2 Have negatively charged substituent for fluorescent staining of DNA; used to distinguish DNA present in a sample from RNA Life Technologies Corporation (US) 2010-02-02 — — US disclosed
US-20090047683-A1 CYANINE DYE COMPOUNDS INVITROGEN CORPORATION (US) 2009-02-19 — — US disclosed
US-7446202-B2 Cyanine dye compounds MOLECULAR PROBES, INC. (US) 2008-11-04 — — US disclosed
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