SCHEMBL17188374

SCHEMBL17188374

CCCCCCCCN1C(=O)c2c(-c3cc(CCCCCC)c(-c4sc(-c5sc(C)cc5CCCCCC)c5c4C(=O)N(CCCCCCCC)C5=O)s3)sc(-c3cc4c(s3)-c3sc(C)cc3[Si]4(CCCCCCCC)CCCCCCCC)c2C1=O

nearest known ligand 0.30

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ PTGS1 P23219 3/20 0.30
▸ PTGS2 P35354 3/20 0.30
▸ MGLL Q99685 2/20 0.30
▸ FAAH O00519 1/20 0.30

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
SCHEMBL17188375 0.87 — —
SCHEMBL14725892 0.87 PTGS1 (0.34) PTGS1PTGS2MGLLFAAH
SCHEMBL15979478 0.87 PTGS1 (0.34) PTGS1PTGS2MGLLFAAH
SCHEMBL16307242 0.86 PTGS1 (0.32) PTGS1PTGS2MGLLFAAH
SCHEMBL13096347 0.83 PTGS1 (0.33) PTGS1PTGS2MGLLFAAH
SCHEMBL13096352 0.83 PTGS1 (0.33) PTGS1PTGS2MGLLFAAH
SCHEMBL17188378 0.83 — —
SCHEMBL14725901 0.83 HSF1 (0.31) PTGS1PTGS2MGLLFAAH
SCHEMBL16307286 0.81 HSF1 (0.33) PTGS1PTGS2MGLLFAAH
SCHEMBL16605153 0.79 — —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9166073-B2 Method for producing conjugated polymer, conjugated polymer, photoelectric conversion element, solar cell, and solar cell module MITSUBISHI CHEMICAL CORPORATION (JP) 2015-10-20 — — US disclosed
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