SCHEMBL9869124

SCHEMBL9869124

CCCCCCCCn1c(C)c(-c2cccc(C(=O)c3cccc(-c4c(C)n(CCCCCCCC)c5ccccc45)c3C(=O)O)c2C(=O)O)c2ccccc21

nearest known ligand 0.62

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ CNR2 P34972 20/20 0.62
▸ CNR1 P21554 11/20 0.62
▸ SLC6A3 Q01959 1/20 0.60

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
SCHEMBL27589738 0.90 CNR2 (0.58) CNR2CNR1SLC6A3
SCHEMBL7840464 0.82 CNR2 (0.77) CNR2CNR1SLC6A3
SCHEMBL9869130 0.82 CNR2 (0.55) CNR2CNR1SLC6A3
SCHEMBL27589707 0.81 KDM4E (0.50) CNR2CNR1SLC6A3
SCHEMBL11315147 0.81 CNR2 (0.76) CNR2CNR1SLC6A3
SCHEMBL29673705 0.80 CNR2 (0.53) CNR2CNR1SLC6A3
SCHEMBL22958896 0.77 CNR2 (0.52) CNR2CNR1SLC6A3
SCHEMBL9657083 0.77 CNR2 (0.50) CNR2CNR1SLC6A3
SCHEMBL11069801 0.77 CNR2 (0.76) CNR2CNR1SLC6A3
SCHEMBL31498033 0.77 CNR2 (0.59) CNR2CNR1SLC6A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5071986-A For pressure or heat sensitive recording materials CIBA-GEIGY CORPORATION (US) 1991-12-10 — — US disclosed
US-4876357-A FOR PRESSURE AND HEAT SENSITIVE ELEMENTS CIBA-GEIGY CORPORATION (US) 1989-10-24 — — US disclosed
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