SCHEMBL7866658

SCHEMBL7866658

N#Cc1c(F)c(F)c(Oc2c(C(=O)OCC3CCCO3)cccc2-c2ccccc2)c(F)c1C#N

nearest known ligand 0.59

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ OXTR P30559 2/20 0.41
▸ AVPR1A P37288 2/20 0.41
▸ MGLL Q99685 3/20 0.39
▸ CHRNB2 P17787 3/20 0.38
▸ CHRNB4 P30926 3/20 0.38
▸ CHRNA3 P32297 3/20 0.38
▸ CHRNA4 P43681 3/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ LDHA P00338 1/20 0.37

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
SCHEMBL7861790 0.87 ALDH1A1 (0.41) L3MBTL1LDHA
SCHEMBL7866643 0.80 SCN1A (0.45) L3MBTL1
SCHEMBL7866670 0.79 TSHR (0.45) CHRNB2CHRNB4CHRNA3CHRNA4L3MBTL1
SCHEMBL7868388 0.77 TSHR (0.47) L3MBTL1
SCHEMBL7866655 0.76 TSHR (0.43) CHRNB2CHRNB4CHRNA3CHRNA4L3MBTL1
SCHEMBL7866661 0.76 SCN1A (0.37) —
SCHEMBL6238950 0.76 ALDH1A1 (0.37) L3MBTL1
SCHEMBL6238946 0.76 SCN1A (0.41) —
SCHEMBL7866640 0.75 SCN1A (0.42) —
SCHEMBL7868297 0.75 SCN1A (0.40) —

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-0882768-B1 Method for producing of phthalocyanine compound NIPPON CATALYTIC CHEM IND (JP) 2001-12-19 — — EP disclosed
US-6034236-A REACTING A PHTHALONITRILE WITH A METAL OXIDE IN PRESENCE OF A SULFONIC ACID CATALYST NIPPON SHOKUBAI CO., LTD. (JP) 2000-03-07 — — US disclosed
EP-0882768-A2 Method for producing of phthalocyanine compound NIPPON SHOKUBAI CO., LTD. (JP) 1998-12-09 — — EP disclosed
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